Tetrabutylammonium hydrogen sulfate (TBAHS)

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2018-03-20 12h:52m:57s (EST)

O– HO

1. Query

S OO

N+

Search as: As drawn AND (IDE.XRN=3599663)

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Reaxys ID 3599663 View in Reaxys

1/1 CAS Registry Number: 2472-88-0 Chemical Name: tetra(n-butyl)ammonium hydrogensulfate; tetrabutylammonium hydrogensulfate; tetra-n-butyl ammonioum hydrogen sulfate; tetrabutylammonium hydrogen sulfate salt; tetra n-butyl ammonium hydrogen sulfate; tetra(n-butyl)ammonium hydrogen sulfate; tetra-n-butyl ammonium hydrogen sulfate Linear Structure Formula: (C4H9)4N(1+)*HSO4 (1-)=[(C H )4N]HSO 4 9 4 Molecular Formula: C16H36N*HO4S Molecular Weight: 339.54 Type of Substance: acyclic InChI Key: SHFJWMWCIHQNCP-UHFFFAOYSA-M Note:

O– N+ HO

S OO

Substance Label (63) Label References Bu4NHSO4

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TBAHS

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hisheak; Jaiswal, Swati; Singh, Sunil Kumar; Kumar, Yogesh; Lal, Jawahar; Trivedi, Arun Kumar; Tripathi, Renu; Tripathi, Rama Pati; European Journal of Medicinal Chemistry; vol. 109; (2016); p. 187 - 198, View in Reaxys; Grzybowski, Marek; Jezewski, Artur; Deperasińska, Irena; Friese, Daniel H.; Banasiewicz, Marzena; Hugues, Vincent; Kozankiewicz, Bolesław; Blanchard-Desce, Mireille; Gryko, Daniel T.; Organic and Biomolecular Chemistry; vol. 14; nb. 6; (2016); p. 2025 - 2033, View in Reaxys; Lai, Ashton C.; Toure, Momar; Hellerschmied, Doris; Salami, Jemilat; Jaime-Figueroa, Saul; Ko, Eunhwa; Hines, John; Crews, Craig M.; Angewandte Chemie - International Edition; vol. 55; nb. 2; (2016); p. 807 - 810; Angew. Chem.; vol. 128; nb. 2; (2016); p. 818 - 821,4, View in Reaxys; Patent; JANSSEN SCIENCES IRELAND UC; JONCKERS, Tim, Hugo, Maria; RABOISSON, Pierre, Jean-Marie, Bernard; GUILLEMONT, Jérôme, Emile, Georges; MC GOWAN, David, Craig; EMBRECHTS, Werner, Constant, Johan; COOYMANS, Ludwig, Paul; MICHAUT, Antoine, Benjamin; (162 pag.); WO2016/20526; (2016); (A1) English, View in Reaxys; Nandi, Raj Kumar; Ratsch, Friederike; Beaud, Rodolphe; Guillot, Régis; Kouklovsky, Cyrille; Vincent, Guillaume; Chemical Communications; vol. 52; nb. 30; (2016); p. 5328 - 5331, View in Reaxys; Reddy, B.V. Subba; Kota, Kavya; Rao, B. Maheshwar; Sridhar; Mukkanti; Tetrahedron Letters; vol. 57; nb. 41; (2016); p. 4529 - 4532, View in Reaxys; Shahroosvand, Hashem; Abaspour, Saeid; Pashaei, Babak; Radicchi, Eros; De Angelis, Filippo; Bonaccorso, Francesco; Chemical Communications; vol. 53; nb. 46; (2017); p. 6211 - 6214, View in Reaxys nBu&4%NHSO&4 %

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Bu&4%NHSO&4 %

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TBAHSO3

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12

Pike, Sarah J.; Hutchinson, Jordan J.; Hunter, Christopher A.; Journal of the American Chemical Society; vol. 139; nb. 19; (2017); p. 6700 - 6706, View in Reaxys

nBu&4%HSO&4%

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n-TBAHSO4

Manna, Utsab; Kayal, Santanu; Nayak, Biswajit; Das, Gopal; Dalton Transactions; vol. 46; nb. 35; (2017); p. 11956 - 11969, View in Reaxys

Bu&4%NHSO4

Tay, Daniel Weiliang; Tsoi, Ivan Tan; Er, Jun Cheng; Leung, Gulice Yiu Chung; Yeung, Ying-Yeung; Organic Letters; vol. 15; nb. 6; (2013); p. 1310 - 1313, View in Reaxys; Patent; Gilead Sciences, Inc.; Clarke, Michael O'Neil Hanrahan; Mackman, Richard L.; Siegel, Dustin; (53 pag.); US2016/24107; (2016); (A1) English, View in Reaxys

nBu&4%HSO&4 %

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TBAS

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THS

Deng, Lin; Xu, Tao; Li, Hongbo; Dong, Guangbin; Journal of the American Chemical Society; vol. 138; nb. 1; (2016); p. 369 - 374, View in Reaxys

TBHAS

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TBAHSO&4%

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524

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PTC

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5e

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TBAHSO4

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TBA-HS

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Bu&4%HSO&4%

Nuti, Elisa; Santamaria, Salvatore; Casalini, Francesca; Yamamoto, Kazuhiro; Marinelli, Luciana; La Pietra, Valeria; Novellino, Ettore; Orlandini, Elisabetta; Nencetti, Susanna; Marini, Anna Maria; Salerno, Silvia; Taliani, Sabrina; Da Settimo, Federico; Nagase, Hideaki; Rossello, Armando; European Journal of Medicinal Chemistry; vol. 62; (2013); p. 379 - 394, View in Reaxys; Perspicace, Enrico; Giorgio, Annalaura; Carotti, Angelo; Marchais-Oberwinkler, Sandrine; Hartmann, Rolf W.; European Journal of Medicinal Chemistry; vol. 69; (2013); p. 201 - 215, View in Reaxys; Kodama, Takeshi; Aoki, Shingo; Matsuo, Tomoki; Tachi, Yoshimitsu; Nishikawa, Keisuke; Morimoto, Yoshiki; Chemistry Letters; vol. 43; nb. 10; (2014); p. 1662 - 1664; Art.No: CL-140618, View in Reaxys

n-Bu4NHSO4

Nunez-Rico, Jose Luis; Vidal-Ferran, Anton; Organic Letters; vol. 15; nb. 8; (2013); p. 2066 - 2069, View in Reaxys; Underwood, Brian S.; Tanuwidjaja, Jessica; Ng, Sze-Sze; Jamison, Timothy F.; Tetrahedron; vol. 69; nb. 25; (2013); p. 5205 - 5220, View in Reaxys; Yeoman, John T.S.; Cha, Jacob Y.; Mak, Victor W.; Reisman, Sarah E.; Tetrahedron; vol. 70; nb. 27-28; (2014); p. 4070 - 4088, View in Reaxys

nBu&4%NHSO&4 Clark, J. Stephen; Romiti, Filippo; Angewandte Chemie - International Edition; vol. 52; nb. 38; (2013); p. % 10072 - 10075; Angew. Chem.; vol. 125; nb. 38; (2013); p. 10256 - 10259,4, View in Reaxys; Hermant, Fabien; Urbaska, Ewelina; Seizilles De Mazancourt, Sarah; Maubert, Thomas; Nicolas, Emmanuel; Six, Yvan; Organometallics; vol. 33; nb. 20; (2014); p. 5643 - 5653, View in Reaxys; Bischoff, Matthias; Sippel, Claudia; Bracher, Andreas; Hausch, Felix; Organic Letters; vol. 16; nb. 20; (2014); p. 5254 - 5257, View in Reaxys nBu&4%N(HSO&4 %)

Yamamura, Masaki; Iida, Masaya; Kanazawa, Kotaro; Sasaki, Masao; Nabeshima, Tatsuya; Bulletin of the Chemical Society of Japan; vol. 87; nb. 2; (2014); p. 334 - 340, View in Reaxys

Bu&4%N HSO&4%

Levin, Mark D.; Toste, F. Dean; Angewandte Chemie - International Edition; vol. 53; nb. 24; (2014); p. 6211 - 6215; Angew. Chem.; vol. 126; nb. 24; (2014); p. 6325 - 6329,5, View in Reaxys

NBu&4%HSO&4 %

Perspicace, Enrico; Cozzoli, Liliana; Gargano, Emanuele M.; Hanke, Nina; Carotti, Angelo; Hartmann, Rolf W.; Marchais-Oberwinkler, Sandrine; European Journal of Medicinal Chemistry; vol. 83; (2014); p. 317 - 337, View in Reaxys

Bu&4%N.HSO&4 %

Gao, Yan; Shan, Dong; Jia, Yanxing; Tetrahedron; vol. 70; nb. 34; (2014); p. 5136 - 5141, View in Reaxys

%n&Bu&4%NHS O&4%

Ariyasu, Shinya; Mizuseda, Yuki; Hanaya, Kengo; Aoki, Shin; Chemical and Pharmaceutical Bulletin; vol. 62; nb. 7; (2014); p. 642 - 648, View in Reaxys

Bu4N(HSO4)

Young, Michael C.; Holloway, Lauren R.; Johnson, Amber M.; Hooley, Richard J.; Angewandte Chemie, International Edition; vol. 53; nb. 37; (2014); p. 9832 - 9836,5; Angewandte Chemie; vol. 126; nb. 37; (2014); p. 9990 - 9994, View in Reaxys

nBu&4%N.HSO& 4%

Arava, Veera Reddy; Amasa, Srinivasulu Reddy; Goud Bhatthula, Bharat Kumar; Kompella, Laxmi Srinivas; Matta, Venkata Prasad; Subha; Synthetic Communications; vol. 43; nb. 21; (2013); p. 2892 - 2897, View in Reaxys

TBAHS; nBu4NHSO4

Walker, P. Ross; Campbell, Craig D.; Suleman, Abid; Carr, Greg; Anderson, Edward A.; Angewandte Chemie - International Edition; vol. 52; nb. 35; (2013); p. 9139 - 9143; Angew. Chem.; vol. 125; nb. 36; (2013); p. 9309 - 9313, View in Reaxys

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[Bu&4%N] [HSO&4%]

Doostmohammadi, Razieh; Maghsoodlou, Malek Taher; Hazeri, Nourallah; Habibi-Khorassani, Sayyed Mostafa; Chinese Chemical Letters; vol. 24; nb. 10; (2013); p. 901 - 903, View in Reaxys

(nBu)&4%NHSO&4 %

Zeng, Qingbei; Rosenblum, Stuart B.; Yang, Zhaoxia; Jiang, Yueheng; McCormick, Kevin D.; Aslanian, Robert G.; Duguma, Luli; Kozlowski, Joseph A.; Shih, Neng-Yang; Hey, John A.; West Jr., Robert E.; Korfmacher, Walter A.; Berlin, Michael; Boyce, Christopher W.; Bioorganic and Medicinal Chemistry Letters; vol. 23; nb. 21; (2013); p. 6001 - 6003, View in Reaxys

(Bu4N)HSO4

Leiren, Marit K.; Valdersnes, Stig; Sydnes, Leiv K.; Helvetica Chimica Acta; vol. 96; nb. 10; (2013); p. 1841 - 1850, View in Reaxys

Bu&4%NSO&4%

Harris, Philip A.; Bandyopadhyay, Deepak; Berger, Scott B.; Campobasso, Nino; Capriotti, Carol A.; Cox, Julie A.; Dare, Lauren; Finger, Joshua N.; Hoffman, Sandra J.; Kahler, Kirsten M.; Lehr, Ruth; Lich, John D.; Nagilla, Rakesh; Nolte, Robert T.; Ouellette, Michael T.; Pao, Christina S.; Schaeffer, Michelle C.; Smallwood, Angela; Sun, Helen H.; Swift, Barbara A.; Totoritis, Rachel D.; Ward, Paris; Marquis, Robert W.; Bertin, John; Gough, Peter J.; ACS Medicinal Chemistry Letters; vol. 4; nb. 12; (2013); p. 1238 - 1243, View in Reaxys

(nBu)4NHSO4

Zhu, Jieping; Chimia; vol. 67; nb. 12; (2013); p. 916 - 920, View in Reaxys

(Bu)4NHSO4

Brace, Neal O.; Journal of Fluorine Chemistry; vol. 102; nb. 1-2; (2000); p. 21 - 41, View in Reaxys; Mercey, Guillaume; Renou, Julien; Verdelet, Tristan; Kliachyna, Maria; Baati, Rachid; Gillon, Emilie; Arboléas, Mélanie; Loiodice, Mélanie; Nachon, Florian; Jean, Ludovic; Renard, Pierre-Yves; Journal of Medicinal Chemistry; vol. 55; nb. 23; (2012); p. 10791 - 10795, View in Reaxys

TBA*HSO4

Chawla, H. M.; Srivastava, Rahul; Sahu, Satya Narayan; Kumar, Satish; Upreti, Shailesh; Supramolecular Chemistry; vol. 24; nb. 9; (2012); p. 672 - 683,12, View in Reaxys; Norris, Timothy; Dowdeswell, Christian; Johnson, Natalka; Daia, Dan; Organic Process Research and Development; vol. 9; nb. 6; (2005); p. 792 - 799, View in Reaxys

Bu4NHSO4; TBAS

Yoshimatsu, Mitsuhiro; Ohta, Katsuki; Takahashi, Nami; Chemistry - A European Journal; vol. 18; nb. 49; (2012); p. 15602 - 15606, View in Reaxys

[Bu&4%N] HSO&4%

Greenaway, Rebecca L.; Campbell, Craig D.; Chapman, Helen A.; Anderson, Edward A.; Advanced Synthesis and Catalysis; vol. 354; nb. 17; (2012); p. 3187 - 3194, View in Reaxys

[Bu&4%N] [HSO&4%&]%

Morales, Dolores; Puerto, Marcos; Del Río, Ignacio; Pérez, Julio; López, Ramón; Chemistry - A European Journal; vol. 18; nb. 50; (2012); p. 16186 - 16195, View in Reaxys

HSO4*N(Bu)4

Bruyneel, Frederic; Enaud, Estelle; Billottet, Ludovic; Vanhulle, Sophie; Marchand-Brynaert, Jacqueline; European Journal of Organic Chemistry; nb. 1; (2008); p. 72 - 79, View in Reaxys

Bu4N(1+)*HSO4( 1-)

Liu, Chuanxiang; Qian, Xuhong; Wang, Jiaobing; Li, Zhong; Tetrahedron Letters; vol. 49; nb. 6; (2008); p. 1087 - 1090, View in Reaxys

Bu4*HSO4

Kwon, Soo Kyung; Kou, Songzi; Kim, Ha Na; Chen, Xiaoqiang; Hwang, Hyejin; Nam, Seong-Won; Kim, So Hyun; Swamy; Park, Sungsu; Yoon, Juyoung; Tetrahedron Letters; vol. 49; nb. 26; (2008); p. 4102 4105, View in Reaxys

nBu4N(1+)*HSO 4(1-)

Lee, Hanna; Chung, Yun Mi; Ahn, Kyo Han; Tetrahedron Letters; vol. 49; nb. 38; (2008); p. 5544 - 5547, View in Reaxys

HSO4(1-)*nBu4N( Gong, Wei-tao; Hiratani, Kazuhisa; Tetrahedron Letters; vol. 49; nb. 39; (2008); p. 5655 - 5657, 1+) View in Reaxys 5

Yang, Seung Gak; Hwang, Je Pil; Park, Min Young; Lee, Kieseung; Kim, Yong Hae; Tetrahedron; vol. 63; nb. 24; (2007); p. 5184 - 5188, View in Reaxys

n-Bu&4%NHSO4

Varie, David L.; Beck, Christopher; Borders, Sandra K.; Brady, Molly D.; Cronin, Jason S.; Ditsworth, Tracy K.; Hay, David A.; Hoard, David W.; Hoying, Richard C.; Linder, Ryan J.; Miller, Richard D.; Moher, Eric D.; Remacle, Jacob R.; Rieck III, John A.; Anderson, David D.; Dodson, Paul N.; Forst, Mindy B.; Pierson, Duane A.; Turpin, Joseph A.; Organic Process Research and Development; vol. 11; nb. 3; (2007); p. 546 - 559, View in Reaxys

TBA-HSO4

Turner, David R.; Paterson, Martin J.; Steed, Jonathan W.; Journal of Organic Chemistry; vol. 71; nb. 4; (2006); p. 1598 - 1608, View in Reaxys

Bu4N(+)*HSO4(-) Kameta, Naohiro; Hiratani, Kazuhisa; Chemistry Letters; vol. 35; nb. 5; (2006); p. 536 - 537, View in Reaxys NBu4HSO4

Macias, Alberto; Ramallal, Antonio Moran; Alonso, Eduardo; Del Pozo, Carlos; Gonzalez, Javier; Journal of Organic Chemistry; vol. 71; nb. 20; (2006); p. 7721 - 7730, View in Reaxys

(TBA)HSO4

Hou, Xiaohong; Kobiro, Kazuya; Tetrahedron; vol. 61; nb. 24; (2005); p. 5866 - 5875, View in Reaxys

<nBu4N><HSO4>

Kang, Sung Ok; Hossain, Md. Alamgir; Powell, Douglas; Bowman-James, Kristin; Chemical Communications; nb. 3; (2005); p. 328 - 330, View in Reaxys

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TBA(1+)*HSO4(1 -)

Sessler, Jonathan L.; An, Deqiang; Cho, Won-Seob; Lynch, Vincent; Marquez, Manuel; Chemistry - A European Journal; vol. 11; nb. 7; (2005); p. 2001 - 2011, View in Reaxys

Bu4N(+)HSO4(-)

Bujok, Robert; Makosza, Mieczyslaw; Synlett; nb. 2; (2004); p. 371 - 373, View in Reaxys

Bu4(+)HSO4(-)

Sessler, Jonathan L.; Katayev, Evgeny; Pantos, G. Dan; Ustynyuk, Yuri A.; Chemical Communications; nb. 11; (2004); p. 1276 - 1277, View in Reaxys

(nBu)4N(1+)*HSO 4(1-)

Chmielewski, Michal; Jurczak, Janusz; Tetrahedron Letters; vol. 45; nb. 31; (2004); p. 6007 - 6010, View in Reaxys

nBu4N(1+)*HSO4( 1-)

Lee, Dong Hoon; Lee, Ho Yong; Hong, Jong-In; Tetrahedron Letters; vol. 43; nb. 40; (2002); p. 7273 7276, View in Reaxys

NHBu4SO4

Alonso, Eduardo; Del Pozo, Carlos; Gonzalez, Javier; Journal of the Chemical Society. Perkin Transactions 1; nb. 4; (2002); p. 571 - 576, View in Reaxys

3c

Rang, Knut; Sandstroem, Jan; Journal of the Chemical Society. Perkin Transactions 2; nb. 4; (1999); p. 827 - 832, View in Reaxys

3e <(C4)4N% +&*HSO4%-&>

Odashima, Kazunori; Ito, Takashi; Tohda, Koji; Umezawa, Yoshio; Chemical and Pharmaceutical Bulletin; vol. 46; nb. 8; (1998); p. 1248 - 1253, View in Reaxys

TBA

Aa, Eric M. Van Der; Wouterse, Alfons C.; Peereboom-Stegeman, Jenny H. J..; Russel, Frans G. M.; Biochemical Pharmacology; vol. 50; nb. 11; (1995); p. 1873 - 1878, View in Reaxys; Dong; Waldron; Galipeau; Cole; Triggle; British journal of pharmacology; vol. 120; nb. 4; (1997); p. 695 - 701, View in Reaxys

Bu&4%N(HSO&4 %)

Buchholz, Rainer; Hoffmann, H. Martin R.; Helvetica Chimica Acta; vol. 74; nb. 6; (1991); p. 1213 - 1220, View in Reaxys

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Florentina; Vanham, Guido Louis Emile; Lewi (deceased), Paulus; US2015/126510; (2015); (A1) English, View in Reaxys; Patent; Clarke, Michael O'Neil Hanrahan; Doerffler, Edward; Mackman, Richard L.; Siegel, Dustin; US2015/133395; (2015); (A1) English, View in Reaxys; Patent; Madsen, Niels Joergen; Sehnal, Petr; Anderson, David George; Nielsen, Bo Rud; US2015/148441; (2015); (A1) English, View in Reaxys; Patent; CUERVO, ANA MARIA; GAVATHIOTIS, EVRIPIDIS; XIN, QISHENG; DAS, BHASKAR C.; US2015/166492; (2015); (A1) English, View in Reaxys; Patent; McKeever, Benedict; Diorazio, Louis Joseph; Jones, Martin Francis; Ferris, Leigh; Janbon, Sophie Laure Marie; Siedlecki, Pawel Stanislaw; Churchill, Gwydion Huw; Crafts, Peter Alan; US2015/175639; (2015); (A1) English, View in Reaxys; Patent; Yamaguchi, Shimpei; Uochi, Yumiko; Agatsuma, Tsutomu; Iwamoto, Susumu; Onodera, Hideyuki; US2015/183809; (2015); (A1) English, View in Reaxys; Patent; Amarnath, U; Suryakiran, U; US2015/197495; (2015); (A1) English, View in Reaxys; Patent; THERAVANCE BIOPHARMA RandD IP, LLC; Fleury, Melissa; Beausoliel, Anne-Marie; Hughes, Adam D.; Long, Daniel D.; Wilton, Donna A.A.; US2015/209352; (2015); (A1) English, View in Reaxys Patent; Wang, Licai; Gao, Zhanxian; Li, Wei; Zheng, Guotong; Dong, Qingxin; Liu, Riping; Wang, Xiaohuan; Zhang, Nan; Wang, Jingzhuang; Cai, Shimian; US2011/301385; (2011); (A1) English, View in Reaxys Patent; Halpern, Marc E.; US2009/69585; (2009); (A1) English, View in Reaxys prophetic catalyst

Patent; Orchid Chemicals and Pharmaceuticals Limited; US2003/225075; (2003); (A1) English, View in Reaxys; Patent; Glenmark Pharmaceuticals Limited; US2006/211866; (2006); (A1) English, View in Reaxys Patent; DAISO CO., LTD.; EP1403267; (2004); (A1) English, View in Reaxys Patent; Marhold, Albrecht; Pleschke, Axel; US2004/92762; (2004); (A1) English, View in Reaxys

prophetic catalyst

Patent; Atofina; US6346650; (2002); (B1) English, View in Reaxys

Druglikeness (1) 1 of 1

LogP

3.508

H Bond Donors

1

H Bond Acceptors

4

Rotatable Bonds

12

TPSA

85.81

Lipinski Number

4

Veber Number

1

Catalyst Investigation (8) 1 of 8

Investigated characteris- Catalytic activity tic(s) Location

supporting information

Nguyen, Truong N.; Nguyen, Thien S.; May, Jeremy A.; Organic Letters; vol. 18; nb. 15; (2016); p. 3786 - 3789, View in Reaxys; McCoull, William; Abrams, Roman D.; Anderson, Erica; Blades, Kevin; Barton, Peter; Box, Matthew; Burgess, Jonathan; Byth, Kate; Cao, Qing; Chuaqui, Claudio; Carbajo, Rodrigo J.; Cheung, Tony; Code, Erin; Ferguson, Andrew D.; Fillery, Shaun; Fuller, Nathan O.; Gangl, Eric; Gao, Ning; Grist, Matthew; Hargreaves, David; Howard, Martin R.; Hu, Jun; Kemmitt, Paul D.; Nelson, Jennifer E.; O’Connell, Nichole; Prince, D. Bryan; Raubo, Piotr; Rawlins, Philip B.; Robb, Graeme R.; Shi, Junjie; Waring, Michael J.; Whittaker, David; Wylot, Marta; Zhu, Xiahui; Journal of Medicinal Chemistry; vol. 60; nb. 10; (2017); p. 4386 - 4402, View in Reaxys 2 of 8

Investigated characteris- Catalytic activity tic(s) Specification of catalysis Phase-transfer catalysis Type of reaction (Catalyst Investigation)

Alkylation

Ilisson, Mihkel; Mäeorg, Uno; Synthetic Communications; vol. 47; nb. 13; (2017); p. 1231 - 1238, View in Reaxys 3 of 8

Investigated characteris- Catalytic activity tic(s)

Copyright © 2018 Reed Elsevier Properties SA. All rights reserved. Authorized use only. Reaxys® and the Reaxys® trademark are owned and protected by Reed Elsevier Properties SA and used under license.

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Devender, Nalmala; Gunjan, Sarika; Chhabra, Stuti; Singh, Kartikey; Pasam, Venkata Reddy; Shukla, Sanjeev K.; Sharma, Abhisheak; Jaiswal, Swati; Singh, Sunil Kumar; Kumar, Yogesh; Lal, Jawahar; Trivedi, Arun Kumar; Tripathi, Renu; Tripathi, Rama Pati; European Journal of Medicinal Chemistry; vol. 109; (2016); p. 187 - 198, View in Reaxys; Parmar, Bhagyashri D.; Sutariya, Tushar R.; Brahmbhatt, Gaurangkumar C.; Parmar, Narsidas J.; Kant, Rajni; Gupta, Vivek K.; Murumkar, Prashant R.; Sharma, Mayank Kumar; Yadav, Mange Ram; Molecular Diversity; vol. 20; nb. 3; (2016); p. 639 - 657, View in Reaxys 4 of 8

Investigated characteris- Catalytic activity tic(s) Specification of catalysis Phase-transfer catalysis Type of reaction (Catalyst Investigation)

Aza-Diels-Alder reaction

Gupta, Ragini; Sharma, Deepti; Verma; Jain, Anshu; Journal of Heterocyclic Chemistry; vol. 53; nb. 1; (2016); p. 38 - 45, View in Reaxys 5 of 8

Investigated characteris- Catalytic activity; Diastereomeric excess tic(s) Specification of catalysis Stereoselective catalysis Type of reaction (Catalyst Investigation)

Cyclization

Lamb, Alan D.; Davey, Peter D.; Driver, Russell W.; Thompson, Amber L.; Smith, Martin D.; Organic Letters; vol. 18; nb. 20; (2016); p. 5372 - 5375, View in Reaxys 6 of 8

Investigated characteris- Catalytic activity tic(s) Location

Paragraph 0047; 0051

Patent; Sichuan Fusida Biotechnology Development Co., Ltd.; Liu, Hu; Wang, Wen; Ma, Qingwei; Chen, Xi; Li, Zhou; Zhang, Hua; Wang, Lei; (22 pag.); CN106008348; (2016); (A) Chinese, View in Reaxys 7 of 8

Investigated characteris- Catalytic activity tic(s) Specification of catalysis Phase-transfer catalysis Parmar, Narsidas J.; Labana, Balvantsingh M.; Barad, Hitesh A.; Kant, Rajni; Gupta, Vivek K.; Monatshefte fur Chemie; vol. 145; nb. 7; (2014); p. 1179 - 1189, View in Reaxys

8 of 8

Investigated characteris- Catalytic activity tic(s) Specification of catalysis Phase-transfer catalysis Type of reaction (Catalyst Investigation)

Reduction

Kaplanek, Robert; Krchnak, Viktor; Tetrahedron Letters; vol. 54; nb. 21; (2013); p. 2600 - 2603, View in Reaxys Melting Point (3) 1 of 3

Melting Point [°C]

171.5

Solvent (Melting Point)

diethyl ether

Sarkar, Abhijit; Sinha, Biswajit; Journal of the Serbian Chemical Society; vol. 78; nb. 8; (2013); p. 1225 - 1240, View in Reaxys 2 of 3

Melting Point [°C]

170

Bart, E.; Meltsin, A.; Huppert, D.; Journal of Physical Chemistry; vol. 98; nb. 13; (1994); p. 3295 - 3299, View in Reaxys 3 of 3

Melting Point [°C]

170 - 171

Solvent (Melting Point)

various solvent(s)

Giorgi, Marco De; Landini, Dario; Maia, Angelamaria; Penso, Michele; Synthetic Communications; vol. 17; nb. 5; (1987); p. 521 - 534, View in Reaxys Association (MCS) (134) 1 of 134

Description (Association Association with compound (MCS))

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Solvent (Association (MCS))

chloroform

Temperature (Association (MCS)) [°C]

24.84

Location

supporting information

Partner (Association (MCS))

4-nitro-phenol

Pike, Sarah J.; Hutchinson, Jordan J.; Hunter, Christopher A.; Journal of the American Chemical Society; vol. 139; nb. 19; (2017); p. 6700 - 6706, View in Reaxys 2 of 134

Description (Association Association with compound (MCS)) Solvent (Association (MCS))

acetonitrile

Temperature (Association (MCS)) [°C]

24.84

Location

supporting information

Partner (Association (MCS))

4-nitro-phenol

Pike, Sarah J.; Hutchinson, Jordan J.; Hunter, Christopher A.; Journal of the American Chemical Society; vol. 139; nb. 19; (2017); p. 6700 - 6706, View in Reaxys 3 of 134

Description (Association Association with compound (MCS)) Solvent (Association (MCS))

chloroform

Temperature (Association (MCS)) [°C]

24.84

Location

supporting information

Partner (Association (MCS))

4-hydroxyazobenzene

Pike, Sarah J.; Hutchinson, Jordan J.; Hunter, Christopher A.; Journal of the American Chemical Society; vol. 139; nb. 19; (2017); p. 6700 - 6706, View in Reaxys 4 of 134

Description (Association Association with compound (MCS)) Solvent (Association (MCS))

acetonitrile

Temperature (Association (MCS)) [°C]

24.84

Location

supporting information

Partner (Association (MCS))

4-hydroxyazobenzene

Pike, Sarah J.; Hutchinson, Jordan J.; Hunter, Christopher A.; Journal of the American Chemical Society; vol. 139; nb. 19; (2017); p. 6700 - 6706, View in Reaxys 5 of 134

Description (Association Association with compound (MCS)) Temperature (Association (MCS)) [°C]

25

Partner (Association (MCS))

rhodamine based gold hybrid

Kaur, Rajinder; Singh, Jasminder; Saini, Anu; Singh, Narinder; Kaur, Navneet; RSC Advances; vol. 4; nb. 89; (2014); p. 48004 - 48011, View in Reaxys 6 of 134

Description (Association Association with compound (MCS))

Copyright © 2018 Reed Elsevier Properties SA. All rights reserved. Authorized use only. Reaxys® and the Reaxys® trademark are owned and protected by Reed Elsevier Properties SA and used under license.

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Solvent (Association (MCS))

[D3]acetonitrile

Partner (Association (MCS))

C44H48N16O4

Pinter, Thomas; Jana, Subrata; Courtemanche, Rebecca J. M.; Hof, Fraser; Journal of Organic Chemistry; vol. 76; nb. 10; (2011); p. 3733 - 3741, View in Reaxys 7 of 134

Description (Association Association with compound (MCS)) Solvent (Association (MCS))

[D3]acetonitrile

Partner (Association (MCS))

C44H48N16O8

Pinter, Thomas; Jana, Subrata; Courtemanche, Rebecca J. M.; Hof, Fraser; Journal of Organic Chemistry; vol. 76; nb. 10; (2011); p. 3733 - 3741, View in Reaxys 8 of 134

Description (Association Association with compound (MCS)) Solvent (Association (MCS))

[D3]acetonitrile

Partner (Association (MCS))

25,26,27,28-tetrakis(methoxyethoxy)-5,11,17,23-tetrakis(p-tolunesulfamoyl)calix[4]arene

Pinter, Thomas; Jana, Subrata; Courtemanche, Rebecca J. M.; Hof, Fraser; Journal of Organic Chemistry; vol. 76; nb. 10; (2011); p. 3733 - 3741, View in Reaxys 9 of 134

Description (Association Association with compound (MCS)) Solvent (Association (MCS))

[D3]acetonitrile

Partner (Association (MCS))

25,26,27,28-tetrakis(methoxyethoxy)-5,11,17,23-tetrakis(4-nitrosulfamoyl)calix[4]arene

Pinter, Thomas; Jana, Subrata; Courtemanche, Rebecca J. M.; Hof, Fraser; Journal of Organic Chemistry; vol. 76; nb. 10; (2011); p. 3733 - 3741, View in Reaxys 10 of 134

Description (Association Association with compound (MCS)) Solvent (Association (MCS))

[D3]acetonitrile

Partner (Association (MCS))

25,26,27,28-tetrakis(methoxyethoxy)-5,11,17,23-tetrakis(acetylsulfonamido)calix[4]arene

Pinter, Thomas; Jana, Subrata; Courtemanche, Rebecca J. M.; Hof, Fraser; Journal of Organic Chemistry; vol. 76; nb. 10; (2011); p. 3733 - 3741, View in Reaxys 11 of 134

Description (Association Association with compound (MCS)) Solvent (Association (MCS))

[D3]acetonitrile

Partner (Association (MCS))

25,26,27,28-tetrakis(methoxyethoxy)-5,11,17,23-tetrakis(benzylsulfonamido)calix[4]arene

Pinter, Thomas; Jana, Subrata; Courtemanche, Rebecca J. M.; Hof, Fraser; Journal of Organic Chemistry; vol. 76; nb. 10; (2011); p. 3733 - 3741, View in Reaxys 12 of 134

Description (Association Further physical properties of the complex (MCS)) Solvent (Association (MCS))

acetonitrile

Partner (Association (MCS))

C29H35N5(2+)*2F6P(1-)

Copyright © 2018 Reed Elsevier Properties SA. All rights reserved. Authorized use only. Reaxys® and the Reaxys® trademark are owned and protected by Reed Elsevier Properties SA and used under license.

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Kim, Sook Kyung; Seo, Dongwon; Han, Su Jung; Son, Guiyoup; Lee, In-Ja; Lee, Chongmok; Lee, Kap Duk; Yoon, Juyoung; Tetrahedron; vol. 64; nb. 27; (2008); p. 6402 - 6405, View in Reaxys 13 of 134

Description (Association Stability constant of the complex with ... (MCS)) Solvent (Association (MCS))

CDCl3

Temperature (Association (MCS)) [°C]

24.85

Partner (Association (MCS))

C37H56N4O6(2+)*2F6P(1-)

Chahar, Mamta; Upreti, Shailesh; Pandey, Pramod S.; Tetrahedron; vol. 63; nb. 1; (2007); p. 171 - 176, View in Reaxys 14 of 134

Description (Association NMR spectrum of the complex (MCS)) Solvent (Association (MCS))

dimethylsulfoxide-d6

Temperature (Association (MCS)) [°C]

24.85

Partner (Association (MCS))

tri(1H-pyrrol-2-yl)methane

Denekamp, Chagit; Suwinska, Kinga; Salman, Hussein; Abraham, Yael; Eichen, Yoav; Ari, J. Ben; Chemistry A European Journal; vol. 13; nb. 2; (2007); p. 657 - 665, View in Reaxys 15 of 134

Description (Association Formation constant of a complex (MCS)) Solvent (Association (MCS))

CDCl3

Temperature (Association (MCS)) [°C]

24.84

Partner (Association (MCS))

C50H61N5O6(2+)*2F6P(1-)

Khatri, Vijay K.; Chahar, Mamta; Pavani; Pandey, Pramod S.; Journal of Organic Chemistry; vol. 72; nb. 26; (2007); p. 10224 - 10226, View in Reaxys 16 of 134

Description (Association Formation constant of a complex (MCS)) Solvent (Association (MCS))

CDCl3

Temperature (Association (MCS)) [°C]

24.84

Partner (Association (MCS))

C42H57N5O6(2+)*2F6P(1-)

Khatri, Vijay K.; Chahar, Mamta; Pavani; Pandey, Pramod S.; Journal of Organic Chemistry; vol. 72; nb. 26; (2007); p. 10224 - 10226, View in Reaxys 17 of 134

Description (Association Formation constant of a complex (MCS)) Solvent (Association (MCS))

CDCl3

Temperature (Association (MCS)) [°C]

24.84

Partner (Association (MCS))

C51H62N4O6(2+)*2F6P(1-)

Khatri, Vijay K.; Chahar, Mamta; Pavani; Pandey, Pramod S.; Journal of Organic Chemistry; vol. 72; nb. 26; (2007); p. 10224 - 10226, View in Reaxys

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18 of 134

Description (Association Formation constant of a complex (MCS)) Solvent (Association (MCS))

CDCl3

Temperature (Association (MCS)) [°C]

24.84

Partner (Association (MCS))

C51H62N4O6(2+)*2F6P(1-)

Khatri, Vijay K.; Chahar, Mamta; Pavani; Pandey, Pramod S.; Journal of Organic Chemistry; vol. 72; nb. 26; (2007); p. 10224 - 10226, View in Reaxys 19 of 134

Description (Association Stability constant of the complex with ... (MCS)) Solvent (Association (MCS))

CDCl3; CD3CN

Temperature (Association (MCS)) [°C]

25

Comment (Association (MCS))

Ratio of solvents: CDCl3-CD3CN 4:1

Partner (Association (MCS))

C52H56N4O14S4

Lhotak, Pavel; Svoboda, Jiri; Stibor, Ivan; Tetrahedron; vol. 62; nb. 6; (2006); p. 1253 - 1257, View in Reaxys 20 of 134

Description (Association Stability constant of the complex with ... (MCS)) Solvent (Association (MCS))

CDCl3; CD3CN

Temperature (Association (MCS)) [°C]

25

Comment (Association (MCS))

Ratio of solvents: CDCl3-CD3CN 4:1

Partner (Association (MCS))

C48H56N2O13S4

Lhotak, Pavel; Svoboda, Jiri; Stibor, Ivan; Tetrahedron; vol. 62; nb. 6; (2006); p. 1253 - 1257, View in Reaxys 21 of 134

Description (Association Association with compound (MCS)) Solvent (Association (MCS))

dimethylsulfoxide-d6

Temperature (Association (MCS)) [°C]

20

Partner (Association (MCS))

C54H60N9O3(3+)*3F6P(1-)

Turner, David R.; Paterson, Martin J.; Steed, Jonathan W.; Journal of Organic Chemistry; vol. 71; nb. 4; (2006); p. 1598 - 1608, View in Reaxys 22 of 134

Description (Association Association with compound (MCS)) Solvent (Association (MCS))

CD3CN

Temperature (Association (MCS)) [°C]

20

Partner (Association (MCS))

C57H90N9O3(3+)*3F6P(1-)

Turner, David R.; Paterson, Martin J.; Steed, Jonathan W.; Journal of Organic Chemistry; vol. 71; nb. 4; (2006); p. 1598 - 1608, View in Reaxys

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23 of 134

Description (Association Stability constant of the complex with ... (MCS)) Solvent (Association (MCS))

acetonitrile; CHCl3

Comment (Association (MCS))

Ratio of solvents: 9:1

Partner (Association (MCS))

C71H64BN3O10

Kameta, Naohiro; Hiratani, Kazuhisa; Chemistry Letters; vol. 35; nb. 5; (2006); p. 536 - 537, View in Reaxys 24 of 134

Description (Association UV/VIS spectrum of the complex (MCS)) Solvent (Association (MCS))

acetonitrile

Partner (Association (MCS))

C76H52N8O10

Kim, Hyun Jung; Kim, Sung Kuk; Lee, Jin Yong; Kim, Jong Seung; Journal of Organic Chemistry; vol. 71; nb. 17; (2006); p. 6611 - 6614, View in Reaxys 25 of 134

Description (Association UV/VIS spectrum of the complex (MCS)) Solvent (Association (MCS))

acetonitrile

Partner (Association (MCS))

C78H56N8O10

Kim, Hyun Jung; Kim, Sung Kuk; Lee, Jin Yong; Kim, Jong Seung; Journal of Organic Chemistry; vol. 71; nb. 17; (2006); p. 6611 - 6614, View in Reaxys 26 of 134

Description (Association UV/VIS spectrum of the complex (MCS)) Solvent (Association (MCS))

acetonitrile

Partner (Association (MCS))

C46H42N6O8

Kim, Hyun Jung; Kim, Sung Kuk; Lee, Jin Yong; Kim, Jong Seung; Journal of Organic Chemistry; vol. 71; nb. 17; (2006); p. 6611 - 6614, View in Reaxys 27 of 134

Description (Association Association with compound (MCS)) Solvent (Association (MCS))

dimethylsulfoxide-d6

Comment (Association (MCS))

ambient temperature

Partner (Association (MCS))

C48H60N16O8

Kang, Sung Ok; Powell, Douglas; Day, Victor W.; Bowman-James, Kristin; Angewandte Chemie - International Edition; vol. 45; nb. 12; (2006); p. 1921 - 1925, View in Reaxys 28 of 134

Description (Association Stability constant of the complex with ... (MCS)) Solvent (Association (MCS))

CH2Cl2

Temperature (Association (MCS)) [°C]

22

Partner (Association (MCS))

2,3-di(1H-indol-3-yl)quinoxaline

Sessler, Jonathan L.; Cho, Dong-Gyu; Lynch, Vincent; Journal of the American Chemical Society; vol. 128; nb. 51; (2006); p. 16518 - 16519, View in Reaxys

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29 of 134

Description (Association Stability constant of the complex with ... (MCS)) Solvent (Association (MCS))

CH2Cl2

Temperature (Association (MCS)) [°C]

22

Partner (Association (MCS))

2,3-di(1H-indol-3-yl)-6-nitroquinoxaline

Sessler, Jonathan L.; Cho, Dong-Gyu; Lynch, Vincent; Journal of the American Chemical Society; vol. 128; nb. 51; (2006); p. 16518 - 16519, View in Reaxys 30 of 134

Description (Association Association with compound (MCS)) Solvent (Association (MCS))

H2O; dimethylsulfoxide

Comment (Association (MCS))

Ratio of solvents: 1:1

Partner (Association (MCS))

picric acid; compound with 5-guanidinocarbonyl-furan-2-carboxylic acid ethylamide

Schmuck, Carsten; Machon, Uwe; European Journal of Organic Chemistry; nb. 19; (2006); p. 4385 - 4392, View in Reaxys 31 of 134

Description (Association Association with compound (MCS)) Solvent (Association (MCS))

CD3CN

Partner (Association (MCS))

4-dimethylamino-benzoic acid 8-(tert-butyl-diphenyl-silanyloxymethyl)-1,3,4,6,7,8-hexahydro-2H-pyrimido[1,2-a]pyrimidin-2-ylmethyl ester; hydrochloride

Hou, Xiaohong; Kobiro, Kazuya; Tetrahedron; vol. 61; nb. 24; (2005); p. 5866 - 5875, View in Reaxys 32 of 134

Description (Association Stability constant of the complex with ... (MCS)) Solvent (Association (MCS))

acetonitrile

Temperature (Association (MCS)) [°C]

25

Partner (Association (MCS))

C36H40N4OS

Sessler, Jonathan L.; An, Deqiang; Cho, Won-Seob; Lynch, Vincent; Yoon, Dae-Wi; Hong, Seong-Jin; Lee, Chang-Hee; Journal of Organic Chemistry; vol. 70; nb. 5; (2005); p. 1511 - 1517, View in Reaxys 33 of 134

Description (Association NMR spectrum of the complex (MCS)) Solvent (Association (MCS))

CDCl3

Partner (Association (MCS))

C74H63N5O8

Ji, Yeon Lee; Sung, Kuk Kim; Jong, Hwa Jung; Jong, Seung Kim; Journal of Organic Chemistry; vol. 70; nb. 4; (2005); p. 1463 - 1466, View in Reaxys 34 of 134

Description (Association NMR spectrum of the complex (MCS)) Solvent (Association (MCS))

CD3CN

Comment (Association (MCS))

concentration dependence. Object(s) of Study: ambient temperature

Partner (Association (MCS))

C33H39N11O6

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Kang, Sung Ok; Hossain, Md. Alamgir; Powell, Douglas; Bowman-James, Kristin; Chemical Communications; nb. 3; (2005); p. 328 - 330, View in Reaxys 35 of 134

Description (Association Stability constant of the complex with ... (MCS)) Solvent (Association (MCS))

CD3CN

Comment (Association (MCS))

ambient temperature

Partner (Association (MCS))

C33H39N11O6

Kang, Sung Ok; Hossain, Md. Alamgir; Powell, Douglas; Bowman-James, Kristin; Chemical Communications; nb. 3; (2005); p. 328 - 330, View in Reaxys 36 of 134

Description (Association Stability constant of the complex with ... (MCS)) Solvent (Association (MCS))

various solvents

Comment (Association (MCS))

acidic solution

Partner (Association (MCS))

C31H39N5O4

Costero, Ana M.; Banuls, M. Jose; Aurell, M. Jose; Ochando, Luis E.; Domenech, Antonio; Tetrahedron; vol. 61; nb. 43; (2005); p. 10309 - 10320, View in Reaxys 37 of 134

Description (Association Stability constant of the complex with ... (MCS)) Solvent (Association (MCS))

various solvents

Temperature (Association (MCS)) [°C]

20

Comment (Association (MCS))

acidic solution

Partner (Association (MCS))

C31H43N5O2

Costero, Ana M.; Banuls, M. Jose; Aurell, M. Jose; Ochando, Luis E.; Domenech, Antonio; Tetrahedron; vol. 61; nb. 43; (2005); p. 10309 - 10320, View in Reaxys 38 of 134

Description (Association Stability constant of the complex with ... (MCS)) Solvent (Association (MCS))

acetonitrile; dimethylsulfoxide-d6

Comment (Association (MCS))

Ratio of solvents: MeCN : DMSO 9 : 1

Partner (Association (MCS))

C19H24N6O5(2+)*2F6P(1-)

In, Sungjae; Seung, Joo Cho; Kyu, Hwan Lee; Kang, Jongmin; Organic Letters; vol. 7; nb. 18; (2005); p. 3993 3996, View in Reaxys 39 of 134

Description (Association Stability constant of the complex with ... (MCS)) Solvent (Association (MCS))

acetonitrile; dimethylsulfoxide-d6

Comment (Association (MCS))

Ratio of solvents: MeCN : DMSO 9 : 1

Partner (Association (MCS))

C18H21N7O6(2+)*2F6P(1-)

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In, Sungjae; Seung, Joo Cho; Kyu, Hwan Lee; Kang, Jongmin; Organic Letters; vol. 7; nb. 18; (2005); p. 3993 3996, View in Reaxys 40 of 134

Description (Association Stability constant of the complex with ... (MCS)) Solvent (Association (MCS))

acetonitrile; dimethylsulfoxide-d6

Comment (Association (MCS))

Ratio of solvents: MeCN : DMSO 9 : 1

Partner (Association (MCS))

C18H22N6O4(2+)*2F6P(1-)

In, Sungjae; Seung, Joo Cho; Kyu, Hwan Lee; Kang, Jongmin; Organic Letters; vol. 7; nb. 18; (2005); p. 3993 3996, View in Reaxys 41 of 134

Description (Association UV/VIS spectrum of the complex (MCS)) Solvent (Association (MCS))

acetonitrile

Partner (Association (MCS))

25,27-bis[(N-(1-pyrenyl)aminocarbonyl)methoxy]-26,28-dipropoxycalix[4]arene

Sung, Kuk Kim; Ju, Han Bok; Bartsch, Richard A.; Jin, Yong Lee; Jong, Seung Kim; Organic Letters; vol. 7; nb. 22; (2005); p. 4839 - 4842, View in Reaxys 42 of 134

Description (Association UV/VIS spectrum of the complex (MCS)) Solvent (Association (MCS))

1,2-dichloro-ethane

Temperature (Association (MCS)) [°C]

23

Partner (Association (MCS))

32,33-diphenyl-2,30-dioxo-16,16-dimethyl-3,10,22,29,35,36-hexaaza-34-thiahexacyclo[29,2,1,112,15,117,20,04,9,023,28]hexatriaconta-5,7,9(4),10,12,14,17,19,21,23,25,27,31,33tetradecaene

Sessler, Jonathan L.; Roznyatovskiy, Vladimir; Dan Pantos; Borisova, Natalya E.; Reshetova, Marina D.; Lynch, Vincent M.; Khrustalev, Victor N.; Ustynyuk, Yuri A.; Organic Letters; vol. 7; nb. 23; (2005); p. 5277 5280, View in Reaxys 43 of 134

Description (Association Stability constant of the complex with ... (MCS)) Solvent (Association (MCS))

1,2-dichloro-ethane

Temperature (Association (MCS)) [°C]

23

Partner (Association (MCS))

14,17-dimethyl-2,29-dioxo-13,18-dipropyl-31,32-diphenyl-3,10,21,28,34,35-hexaaza-33thiahexacyclo[29,2,1,112,15,116,19,04,9,022,27]pentatriaconta-5,7,9(4), 10,12,14,16,18,20,22,24,26,30,32-tetradecaene

Sessler, Jonathan L.; Roznyatovskiy, Vladimir; Dan Pantos; Borisova, Natalya E.; Reshetova, Marina D.; Lynch, Vincent M.; Khrustalev, Victor N.; Ustynyuk, Yuri A.; Organic Letters; vol. 7; nb. 23; (2005); p. 5277 5280, View in Reaxys 44 of 134

Description (Association Stability constant of the complex with ... (MCS)) Solvent (Association (MCS))

1,2-dichloro-ethane

Temperature (Association (MCS)) [°C]

23

Partner (Association (MCS))

32,33-diphenyl-2,30-dioxo-16,16-dimethyl-3,10,22,29,35,36-hexaaza-34-thiahexacyclo[29,2,1,112,15,117,20,04,9,023,28]hexatriaconta-5,7,9(4),10,12,14,17,19,21,23,25,27,31,33tetradecaene

Copyright © 2018 Reed Elsevier Properties SA. All rights reserved. Authorized use only. Reaxys® and the Reaxys® trademark are owned and protected by Reed Elsevier Properties SA and used under license.

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Sessler, Jonathan L.; Roznyatovskiy, Vladimir; Dan Pantos; Borisova, Natalya E.; Reshetova, Marina D.; Lynch, Vincent M.; Khrustalev, Victor N.; Ustynyuk, Yuri A.; Organic Letters; vol. 7; nb. 23; (2005); p. 5277 5280, View in Reaxys 45 of 134

Description (Association UV/VIS spectrum of the complex (MCS)) Solvent (Association (MCS))

1,2-dichloro-ethane

Temperature (Association (MCS)) [°C]

23

Partner (Association (MCS))

14,17-dimethyl-2,29-dioxo-13,18-dipropyl-31,32-diphenyl-3,10,21,28,34,35-hexaaza-33thiahexacyclo[29,2,1,112,15,116,19,04,9,022,27]pentatriaconta-5,7,9(4), 10,12,14,16,18,20,22,24,26,30,32-tetradecaene

Sessler, Jonathan L.; Roznyatovskiy, Vladimir; Dan Pantos; Borisova, Natalya E.; Reshetova, Marina D.; Lynch, Vincent M.; Khrustalev, Victor N.; Ustynyuk, Yuri A.; Organic Letters; vol. 7; nb. 23; (2005); p. 5277 5280, View in Reaxys 46 of 134

Description (Association UV/VIS spectrum of the complex (MCS)) Solvent (Association (MCS))

dimethylsulfoxide

Partner (Association (MCS))

1-(4-nitro-phenyl)-3-{8-[3-(4-nitro-phenyl)-ureido]-naphthalen-1-yl}-urea

Eun, Jin Cho; Byung, Ju Ryu; Young, Ju Lee; Kye, Chun Nam; Organic Letters; vol. 7; nb. 13; (2005); p. 2607 2609, View in Reaxys 47 of 134

Description (Association UV/VIS spectrum of the complex (MCS)) Solvent (Association (MCS))

dimethylsulfoxide

Partner (Association (MCS))

1-(2-nitro-phenyl)-3-{8-[3-(2-nitro-phenyl)-ureido]-naphthalen-1-yl}-urea

Eun, Jin Cho; Byung, Ju Ryu; Young, Ju Lee; Kye, Chun Nam; Organic Letters; vol. 7; nb. 13; (2005); p. 2607 2609, View in Reaxys 48 of 134

Description (Association UV/VIS spectrum of the complex (MCS)) Solvent (Association (MCS))

dimethylsulfoxide

Partner (Association (MCS))

1-(4-phenylazo-phenyl)-3-{8-[3-(4-phenylazo-phenyl)-ureido]-naphthalen-1-yl}-urea

Eun, Jin Cho; Byung, Ju Ryu; Young, Ju Lee; Kye, Chun Nam; Organic Letters; vol. 7; nb. 13; (2005); p. 2607 2609, View in Reaxys 49 of 134

Description (Association Further physical properties of the complex (MCS)) Solvent (Association (MCS))

acetonitrile

Partner (Association (MCS))

2-phenyl-1(3)H-anthra[1,2-d]imidazole-6,11-dione

Peng, Xiaojun; Wu, Yunkou; Fan, Jiangli; Tian, Maozhong; Han, Keli; Journal of Organic Chemistry; vol. 70; nb. 25; (2005); p. 10524 - 10531, View in Reaxys 50 of 134

Description (Association Further physical properties of the complex (MCS)) Solvent (Association (MCS))

acetonitrile

Partner (Association (MCS))

2-(4-nitrophenyl)-1(3)H-anthra[1,2-d]imidazole-6,11-dione

Copyright © 2018 Reed Elsevier Properties SA. All rights reserved. Authorized use only. Reaxys® and the Reaxys® trademark are owned and protected by Reed Elsevier Properties SA and used under license.

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Peng, Xiaojun; Wu, Yunkou; Fan, Jiangli; Tian, Maozhong; Han, Keli; Journal of Organic Chemistry; vol. 70; nb. 25; (2005); p. 10524 - 10531, View in Reaxys 51 of 134

Description (Association Stability constant of the complex with ... (MCS)) Solvent (Association (MCS))

acetonitrile

Temperature (Association (MCS)) [°C]

23

Partner (Association (MCS))

C45H49N7O2

Sessler, Jonathan L.; Katayev, Evgeny; Dan Pantos; Scherbakov, Pavel; Reshetova, Marina D.; Khrustalev, Victor N.; Lynch, Vincent M.; Ustynyuk, Yuri A.; Journal of the American Chemical Society; vol. 127; nb. 32; (2005); p. 11442 - 11446, View in Reaxys 52 of 134

Description (Association Stability constant of the complex with ... (MCS)) Solvent (Association (MCS))

acetonitrile

Temperature (Association (MCS)) [°C]

23

Partner (Association (MCS))

C45H45N7O2

Sessler, Jonathan L.; Katayev, Evgeny; Dan Pantos; Scherbakov, Pavel; Reshetova, Marina D.; Khrustalev, Victor N.; Lynch, Vincent M.; Ustynyuk, Yuri A.; Journal of the American Chemical Society; vol. 127; nb. 32; (2005); p. 11442 - 11446, View in Reaxys 53 of 134

Description (Association Stability constant of the complex with ... (MCS)) Solvent (Association (MCS))

CDCl3

Temperature (Association (MCS)) [°C]

24

Partner (Association (MCS))

5,5'-di-tert-butyl-2,2'-dihydroxybiphenyl

Ito, Kazuaki; Nishiki, Makoto; Ohba, Yoshihiro; Chemical and Pharmaceutical Bulletin; vol. 53; nb. 10; (2005); p. 1352 - 1354, View in Reaxys 54 of 134

Description (Association NMR spectrum of the complex (MCS)) Solvent (Association (MCS))

CDCl3

Temperature (Association (MCS)) [°C]

24

Partner (Association (MCS))

5,5'-di-tert-butyl-2,2'-dihydroxybiphenyl

Ito, Kazuaki; Nishiki, Makoto; Ohba, Yoshihiro; Chemical and Pharmaceutical Bulletin; vol. 53; nb. 10; (2005); p. 1352 - 1354, View in Reaxys 55 of 134

Description (Association Stability constant of the complex with ... (MCS)) Solvent (Association (MCS))

CDCl3

Temperature (Association (MCS)) [°C]

24

Partner (Association (MCS))

bis(5-tert-butyl-2-hydroxyphenyl)methane

Copyright © 2018 Reed Elsevier Properties SA. All rights reserved. Authorized use only. Reaxys® and the Reaxys® trademark are owned and protected by Reed Elsevier Properties SA and used under license.

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Ito, Kazuaki; Nishiki, Makoto; Ohba, Yoshihiro; Chemical and Pharmaceutical Bulletin; vol. 53; nb. 10; (2005); p. 1352 - 1354, View in Reaxys 56 of 134

Description (Association Stability constant of the complex with ... (MCS)) Solvent (Association (MCS))

CD2Cl2

Partner (Association (MCS))

5,5'-dimethyldipyrromethane

Sessler, Jonathan L.; An, Deqiang; Cho, Won-Seob; Lynch, Vincent; Marquez, Manuel; Chemistry - A European Journal; vol. 11; nb. 7; (2005); p. 2001 - 2011, View in Reaxys 57 of 134

Description (Association Stability constant of the complex with ... (MCS)) Solvent (Association (MCS))

1,2-dichloro-ethane

Temperature (Association (MCS)) [°C]

30

Comment (Association (MCS))

diagram

Partner (Association (MCS))

C68H64N8

Sessler, Jonathan L.; An, Deqiang; Cho, Won-Seob; Lynch, Vincent; Marquez, Manuel; Chemistry - A European Journal; vol. 11; nb. 7; (2005); p. 2001 - 2011, View in Reaxys 58 of 134

Description (Association Stability constant of the complex with ... (MCS)) Solvent (Association (MCS))

CD2Cl2

Partner (Association (MCS))

5,10,15,20,22,24-hexahydro-5,5,10,10,15,15,20,20-octamethyl-21H,23H-porphine

Sessler, Jonathan L.; An, Deqiang; Cho, Won-Seob; Lynch, Vincent; Marquez, Manuel; Chemistry - A European Journal; vol. 11; nb. 7; (2005); p. 2001 - 2011, View in Reaxys 59 of 134

Description (Association Stability constant of the complex with ... (MCS)) Solvent (Association (MCS))

1,2-dichloro-ethane

Temperature (Association (MCS)) [°C]

30

Comment (Association (MCS))

solvent dependence. Object(s) of Study: temperature dependence. Object(s) of Study: diagram

Partner (Association (MCS))

C34H32N4

Sessler, Jonathan L.; An, Deqiang; Cho, Won-Seob; Lynch, Vincent; Marquez, Manuel; Chemistry - A European Journal; vol. 11; nb. 7; (2005); p. 2001 - 2011, View in Reaxys 60 of 134

Description (Association Stability constant of the complex with ... (MCS)) Solvent (Association (MCS))

1,2-dichloro-ethane

Temperature (Association (MCS)) [°C]

30

Comment (Association (MCS))

diagram. Object(s) of Study: solvent dependence. Object(s) of Study: temperature dependence

Partner (Association (MCS))

C51H48N6

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Sessler, Jonathan L.; An, Deqiang; Cho, Won-Seob; Lynch, Vincent; Marquez, Manuel; Chemistry - A European Journal; vol. 11; nb. 7; (2005); p. 2001 - 2011, View in Reaxys 61 of 134

Description (Association Stability constant of the complex with ... (MCS)) Solvent (Association (MCS))

CD2Cl2

Comment (Association (MCS))

diagram

Partner (Association (MCS))

2-[3-(1H-pyrrol-2-yl)phenyl]-1H-pyrrole

Sessler, Jonathan L.; An, Deqiang; Cho, Won-Seob; Lynch, Vincent; Marquez, Manuel; Chemistry - A European Journal; vol. 11; nb. 7; (2005); p. 2001 - 2011, View in Reaxys 62 of 134

Description (Association Stability constant of the complex with ... (MCS)) Temperature (Association (MCS)) [°C]

25

Partner (Association (MCS))

C28H30N10(4+)*4F6P(1-)

Chellappan, Kavitha; Singh, N. Jiten; Hwang, In-Chul; Jung, Woo Lee; Kim, Kwang S.; Angewandte Chemie International Edition; vol. 44; nb. 19; (2005); p. 2899 - 2903, View in Reaxys 63 of 134

Description (Association Stability constant of the complex with ... (MCS)) Solvent (Association (MCS))

dimethylsulfoxide

Comment (Association (MCS))

ambient temperature

Partner (Association (MCS))

C41H57N11O6(2+)*2I(1-)

Kang, Sung Ok; Powell, Douglas; Bowman-James, Kristin; Journal of the American Chemical Society; vol. 127; nb. 39; (2005); p. 13478 - 13479, View in Reaxys 64 of 134

Description (Association NMR spectrum of the complex (MCS)) Solvent (Association (MCS))

dimethylsulfoxide-d6

Comment (Association (MCS))

ambient temperature

Partner (Association (MCS))

C41H57N11O6(2+)*2I(1-)

Kang, Sung Ok; Powell, Douglas; Bowman-James, Kristin; Journal of the American Chemical Society; vol. 127; nb. 39; (2005); p. 13478 - 13479, View in Reaxys 65 of 134

Description (Association Stability constant of the complex with ... (MCS)) Solvent (Association (MCS))

dimethylsulfoxide

Comment (Association (MCS))

ambient temperature

Partner (Association (MCS))

C33H39N11O6

Kang, Sung Ok; Powell, Douglas; Bowman-James, Kristin; Journal of the American Chemical Society; vol. 127; nb. 39; (2005); p. 13478 - 13479, View in Reaxys 66 of 134

Description (Association NMR spectrum of the complex (MCS))

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Solvent (Association (MCS))

dimethylsulfoxide-d6

Comment (Association (MCS))

ambient temperature

Partner (Association (MCS))

C33H39N11O6

Kang, Sung Ok; Powell, Douglas; Bowman-James, Kristin; Journal of the American Chemical Society; vol. 127; nb. 39; (2005); p. 13478 - 13479, View in Reaxys 67 of 134

Description (Association NMR spectrum of the complex (MCS)) Solvent (Association (MCS))

dimethylsulfoxide-d6

Comment (Association (MCS))

ambient temperature

Partner (Association (MCS))

C39H51N11O6

Kang, Sung Ok; Powell, Douglas; Bowman-James, Kristin; Journal of the American Chemical Society; vol. 127; nb. 39; (2005); p. 13478 - 13479, View in Reaxys 68 of 134

Description (Association Stability constant of the complex with ... (MCS)) Solvent (Association (MCS))

dimethylsulfoxide

Comment (Association (MCS))

ambient temperature

Partner (Association (MCS))

C39H51N11O6

Kang, Sung Ok; Powell, Douglas; Bowman-James, Kristin; Journal of the American Chemical Society; vol. 127; nb. 39; (2005); p. 13478 - 13479, View in Reaxys 69 of 134

Description (Association Stability constant of the complex with ... (MCS)) Solvent (Association (MCS))

acetonitrile

Temperature (Association (MCS)) [°C]

25

Partner (Association (MCS))

C74H74N14O4

Katayev, Evgeny A.; Pantos, G. Dan; Reshetova, Marina D.; Khrustalev, Victor N.; Lynch, Vincent M.; Ustynyuk, Yuri A.; Sessler, Jonathan L.; Angewandte Chemie - International Edition; vol. 44; nb. 45; (2005); p. 7386 7390, View in Reaxys 70 of 134

Description (Association UV/VIS spectrum of the complex (MCS)) Solvent (Association (MCS))

acetonitrile

Temperature (Association (MCS)) [°C]

25

Partner (Association (MCS))

C74H74N14O4

Katayev, Evgeny A.; Pantos, G. Dan; Reshetova, Marina D.; Khrustalev, Victor N.; Lynch, Vincent M.; Ustynyuk, Yuri A.; Sessler, Jonathan L.; Angewandte Chemie - International Edition; vol. 44; nb. 45; (2005); p. 7386 7390, View in Reaxys 71 of 134

Description (Association NMR spectrum of the complex (MCS))

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Solvent (Association (MCS))

CD3CN

Temperature (Association (MCS)) [°C]

24.85

Partner (Association (MCS))

C52H52N4

Chang, Kyoung-Jin; Moon, Dohyun; Myoung, Soo Lah; Jeong, Kyu-Sung; Angewandte Chemie - International Edition; vol. 44; nb. 48; (2005); p. 7926 - 7929, View in Reaxys 72 of 134

Description (Association Stability constant of the complex with ... (MCS)) Solvent (Association (MCS))

acetonitrile

Temperature (Association (MCS)) [°C]

21.85

Partner (Association (MCS))

C52H52N4

Chang, Kyoung-Jin; Moon, Dohyun; Myoung, Soo Lah; Jeong, Kyu-Sung; Angewandte Chemie - International Edition; vol. 44; nb. 48; (2005); p. 7926 - 7929, View in Reaxys 73 of 134

Description (Association Further physical properties of the complex (MCS)) Solvent (Association (MCS))

acetonitrile

Temperature (Association (MCS)) [°C]

24.85

Partner (Association (MCS))

C52H52N4

Chang, Kyoung-Jin; Moon, Dohyun; Myoung, Soo Lah; Jeong, Kyu-Sung; Angewandte Chemie - International Edition; vol. 44; nb. 48; (2005); p. 7926 - 7929, View in Reaxys 74 of 134

Description (Association NMR spectrum of the complex (MCS)) Solvent (Association (MCS))

CD3CN

Temperature (Association (MCS)) [°C]

24.85

Partner (Association (MCS))

C56H52N4

Chang, Kyoung-Jin; Moon, Dohyun; Myoung, Soo Lah; Jeong, Kyu-Sung; Angewandte Chemie - International Edition; vol. 44; nb. 48; (2005); p. 7926 - 7929, View in Reaxys 75 of 134

Description (Association Stability constant of the complex with ... (MCS)) Solvent (Association (MCS))

acetonitrile

Temperature (Association (MCS)) [°C]

21.85

Partner (Association (MCS))

C56H52N4

Chang, Kyoung-Jin; Moon, Dohyun; Myoung, Soo Lah; Jeong, Kyu-Sung; Angewandte Chemie - International Edition; vol. 44; nb. 48; (2005); p. 7926 - 7929, View in Reaxys 76 of 134

Description (Association Further physical properties of the complex (MCS)) Solvent (Association (MCS))

acetonitrile

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Temperature (Association (MCS)) [°C]

24.85

Partner (Association (MCS))

C56H52N4

Chang, Kyoung-Jin; Moon, Dohyun; Myoung, Soo Lah; Jeong, Kyu-Sung; Angewandte Chemie - International Edition; vol. 44; nb. 48; (2005); p. 7926 - 7929, View in Reaxys 77 of 134

Description (Association Stability constant of the complex with ... (MCS)) Solvent (Association (MCS))

CH2Cl2

Comment (Association (MCS))

ambient temperature

Partner (Association (MCS))

C21H29BF2N2O2

Maeda, Hiromitsu; Kusunose, Yukio; Chemistry - A European Journal; vol. 11; nb. 19; (2005); p. 5661 - 5666, View in Reaxys 78 of 134

Description (Association UV/VIS spectrum of the complex (MCS)) Solvent (Association (MCS))

CH2Cl2

Partner (Association (MCS))

C21H29BF2N2O2

Maeda, Hiromitsu; Kusunose, Yukio; Chemistry - A European Journal; vol. 11; nb. 19; (2005); p. 5661 - 5666, View in Reaxys 79 of 134

Description (Association Further physical properties of the complex (MCS)) Solvent (Association (MCS))

CH2Cl2

Partner (Association (MCS))

C21H29BF2N2O2

Maeda, Hiromitsu; Kusunose, Yukio; Chemistry - A European Journal; vol. 11; nb. 19; (2005); p. 5661 - 5666, View in Reaxys 80 of 134

Description (Association Further physical properties of the complex (MCS)) Solvent (Association (MCS))

acetonitrile; dimethylsulfoxide

Comment (Association (MCS))

Ratio of solvents: MeCN:DMSO = 9:1, v/v

Partner (Association (MCS))

C38H30N4(2+)*2F6P(1-)

Yoon, Juyoung; Kim, Sook Kyung; Singh, N. Jiten; Lee, Jung Woo; Yang, Yun Jung; Chellappan, Kavitha; Kim, Kwang S.; Journal of Organic Chemistry; vol. 69; nb. 2; (2004); p. 581 - 583, View in Reaxys 81 of 134

Description (Association UV/VIS spectrum of the complex (MCS)) Solvent (Association (MCS))

acetonitrile

Temperature (Association (MCS)) [°C]

25

Partner (Association (MCS))

bis-N,N'-(4-nitrophenyl)urea

Boiocchi, Massimo; Del Boca, Laura; Gomez, David Esteban; Fabbrizzi, Luigi; Licchelli, Maurizio; Monzani, Enrico; Journal of the American Chemical Society; vol. 126; nb. 50; (2004); p. 16507 - 16514, View in Reaxys

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82 of 134

Description (Association Stability constant of the complex with ... (MCS)) Solvent (Association (MCS))

dimethylsulfoxide-d6; H2O

Temperature (Association (MCS)) [°C]

24.85

Comment (Association (MCS))

Ratio of solvents: 95:5

Partner (Association (MCS))

bis-N-phenylamide-5,5'-methylenebis(4-ethyl-3-methyl-2-pyrrolecarboxylate)

Vega, Ismael El Drubi; Gale, Philip A.; Hursthouse, Michael B.; Light, Mark E.; Organic and Biomolecular Chemistry; vol. 2; nb. 20; (2004); p. 2935 - 2941, View in Reaxys 83 of 134

Description (Association Stability constant of the complex with ... (MCS)) Solvent (Association (MCS))

dimethylsulfoxide-d6; H2O

Temperature (Association (MCS)) [°C]

24.85

Comment (Association (MCS))

Ratio of solvents: 95:5

Partner (Association (MCS))

bis-N-butylamide-5,5'-methylenebis(4-ethyl-3-methyl-2-pyrrolecarboxylate)

Vega, Ismael El Drubi; Gale, Philip A.; Hursthouse, Michael B.; Light, Mark E.; Organic and Biomolecular Chemistry; vol. 2; nb. 20; (2004); p. 2935 - 2941, View in Reaxys 84 of 134

Description (Association UV/VIS spectrum of the complex (MCS)) Solvent (Association (MCS))

acetonitrile

Partner (Association (MCS))

23,23-dimethyl-3,9-dioxo-2,10,17,29,35,36,37-heptaazahexacyclo[28,4,14,8,119,22,124,27,011,16,01,30]heptatriaconta-4,6,8(35),11(16), 12,14,17,19,21,24,26,28,30,32,34-pentadecaene

Sessler, Jonathan L.; Katayev, Evgeny; Pantos, G. Dan; Ustynyuk, Yuri A.; Chemical Communications; nb. 11; (2004); p. 1276 - 1277, View in Reaxys 85 of 134

Description (Association Stability constant of the complex with ... (MCS)) Solvent (Association (MCS))

acetonitrile

Partner (Association (MCS))

23,23-dimethyl-3,9-dioxo-2,10,17,29,35,36,37-heptaazahexacyclo[28,4,14,8,119,22,124,27,011,16,01,30]heptatriaconta-4,6,8(35),11(16), 12,14,17,19,21,24,26,28,30,32,34-pentadecaene

Sessler, Jonathan L.; Katayev, Evgeny; Pantos, G. Dan; Ustynyuk, Yuri A.; Chemical Communications; nb. 11; (2004); p. 1276 - 1277, View in Reaxys 86 of 134

Description (Association Stability constant of the complex with ... (MCS)) Solvent (Association (MCS))

acetonitrile

Partner (Association (MCS))

tetrakis(1-β-D-galactosylthioureidomethyl)tetramethyl cavitand

Oshovsky, Gennady V.; Verboom, Willem; Fokkens, Roel H.; Reinhoudt, David N.; Chemistry - A European Journal; vol. 10; nb. 11; (2004); p. 2739 - 2748, View in Reaxys 87 of 134

Description (Association Stability constant of the complex with ... (MCS))

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Solvent (Association (MCS))

acetonitrile

Partner (Association (MCS))

tetrakis(1-β-D-glucosylthioureidomethyl)tetramethyl cavitand

Oshovsky, Gennady V.; Verboom, Willem; Fokkens, Roel H.; Reinhoudt, David N.; Chemistry - A European Journal; vol. 10; nb. 11; (2004); p. 2739 - 2748, View in Reaxys 88 of 134

Description (Association Stability constant of the complex with ... (MCS)) Solvent (Association (MCS))

acetonitrile

Partner (Association (MCS))

tetrakis(1-tetra-O-acetyl-β-D-acetylglucosylthioureidomethyl)tetramethyl cavitand

Oshovsky, Gennady V.; Verboom, Willem; Fokkens, Roel H.; Reinhoudt, David N.; Chemistry - A European Journal; vol. 10; nb. 11; (2004); p. 2739 - 2748, View in Reaxys 89 of 134

Description (Association Stability constant of the complex with ... (MCS)) Solvent (Association (MCS))

acetonitrile

Partner (Association (MCS))

tetrakis(1-tetra-O-acetyl-β-D-galactosylthioureidomethyl)tetramethyl cavitand

Oshovsky, Gennady V.; Verboom, Willem; Fokkens, Roel H.; Reinhoudt, David N.; Chemistry - A European Journal; vol. 10; nb. 11; (2004); p. 2739 - 2748, View in Reaxys 90 of 134

Description (Association NMR spectrum of the complex (MCS)) Solvent (Association (MCS))

CDCl3; dimethylsulfoxide-d6

Temperature (Association (MCS)) [°C]

22.85

Comment (Association (MCS))

Ratio of solvents: 98:2

Partner (Association (MCS))

C48H39N3O9

Choi, Kihang; Hamilton, Andrew D.; Journal of the American Chemical Society; vol. 125; nb. 34; (2003); p. 10241 - 10249, View in Reaxys 91 of 134

Description (Association Stability constant of the complex with ... (MCS)) Solvent (Association (MCS))

dimethylsulfoxide-d6; CDCl3

Temperature (Association (MCS)) [°C]

22.85

Comment (Association (MCS))

Ratio of solvents: 1:1

Partner (Association (MCS))

C54H54N6O9

Choi, Kihang; Hamilton, Andrew D.; Journal of the American Chemical Society; vol. 125; nb. 34; (2003); p. 10241 - 10249, View in Reaxys 92 of 134

Description (Association NMR spectrum of the complex (MCS)) Solvent (Association (MCS))

dimethylsulfoxide-d6

Temperature (Association (MCS)) [°C]

22.85

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Partner (Association (MCS))

C54H54N6O9

Choi, Kihang; Hamilton, Andrew D.; Journal of the American Chemical Society; vol. 125; nb. 34; (2003); p. 10241 - 10249, View in Reaxys 93 of 134

Description (Association Stability constant of the complex with ... (MCS)) Solvent (Association (MCS))

dimethylsulfoxide-d6

Comment (Association (MCS))

ambient temperature

Partner (Association (MCS))

C33H39N11O6

Kang, Sung Ok; Llinares, Jose M.; Powell, Douglas; VanderVelde, David; Bowman-James, Kristin; Journal of the American Chemical Society; vol. 125; nb. 34; (2003); p. 10152 - 10153, View in Reaxys 94 of 134

Description (Association Stability constant of the complex with ... (MCS)) Solvent (Association (MCS))

CD3CN

Temperature (Association (MCS)) [°C]

25

Partner (Association (MCS))

2,2'-bipyrrole

Sessler, Jonathan L.; An, Deqiang; Cho, Won-Seob; Lynch, Vincent; Journal of the American Chemical Society; vol. 125; nb. 45; (2003); p. 13646 - 13647, View in Reaxys 95 of 134

Description (Association NMR spectrum of the complex (MCS)) Comment (Association (MCS))

concentration dependence

Partner (Association (MCS))

2,2'-bipyrrole

Sessler, Jonathan L.; An, Deqiang; Cho, Won-Seob; Lynch, Vincent; Journal of the American Chemical Society; vol. 125; nb. 45; (2003); p. 13646 - 13647, View in Reaxys 96 of 134

Description (Association Stability constant of the complex with ... (MCS)) Solvent (Association (MCS))

CD3CN

Temperature (Association (MCS)) [°C]

25

Partner (Association (MCS))

calix[2]bipyrrole[2]furan

Sessler, Jonathan L.; An, Deqiang; Cho, Won-Seob; Lynch, Vincent; Journal of the American Chemical Society; vol. 125; nb. 45; (2003); p. 13646 - 13647, View in Reaxys 97 of 134

Description (Association Stability constant of the complex with ... (MCS)) Solvent (Association (MCS))

CD3CN

Temperature (Association (MCS)) [°C]

25

Partner (Association (MCS))

calix[2]bipyrrole[2]thiophene

Sessler, Jonathan L.; An, Deqiang; Cho, Won-Seob; Lynch, Vincent; Journal of the American Chemical Society; vol. 125; nb. 45; (2003); p. 13646 - 13647, View in Reaxys

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98 of 134

Description (Association Formation constant of a complex (MCS)) Solvent (Association (MCS))

dimethylsulfoxide-d6; H2O

Temperature (Association (MCS)) [°C]

24.84

Partner (Association (MCS))

bis-N-butylamide-5,5'-methylenebis(4-ethyl-3-methyl-2-pyrrolecarboxylate)

Vega, Ismael El Drubi; Camiolo, Salvatore; Gale, Philip A.; Hursthouse, Michael B.; Light, Mark E.; Chemical Communications; nb. 14; (2003); p. 1686 - 1687, View in Reaxys 99 of 134

Description (Association Formation constant of a complex (MCS)) Solvent (Association (MCS))

dimethylsulfoxide-d6; H2O

Temperature (Association (MCS)) [°C]

24.84

Partner (Association (MCS))

bis-N-phenylamide-5,5'-methylenebis(4-ethyl-3-methyl-2-pyrrolecarboxylate)

Vega, Ismael El Drubi; Camiolo, Salvatore; Gale, Philip A.; Hursthouse, Michael B.; Light, Mark E.; Chemical Communications; nb. 14; (2003); p. 1686 - 1687, View in Reaxys 100 of 134 Description (Association UV/VIS spectrum of the complex (MCS)) Solvent (Association (MCS))

acetonitrile

Partner (Association (MCS))

1-butyl-3-[5-[(3-butyl-thioureido)-methyl]-3-(4-diethylamino-2-methyl-phenylimino)-6-oxocyclohexa-1,4-dienylmethyl]-thiourea

Lee, Dong Hoon; Lee, Ho Yong; Hong, Jong-In; Tetrahedron Letters; vol. 43; nb. 40; (2002); p. 7273 - 7276, View in Reaxys 101 of 134 Description (Association UV/VIS spectrum of the complex (MCS)) Solvent (Association (MCS))

CHCl3

Partner (Association (MCS))

1-butyl-3-[5-[(3-butyl-thioureido)-methyl]-3-(4-diethylamino-2-methyl-phenylimino)-6-oxocyclohexa-1,4-dienylmethyl]-thiourea

Lee, Dong Hoon; Lee, Ho Yong; Hong, Jong-In; Tetrahedron Letters; vol. 43; nb. 40; (2002); p. 7273 - 7276, View in Reaxys 102 of 134 Description (Association Stability constant of the complex with ... (MCS)) Solvent (Association (MCS))

CHCl3

Temperature (Association (MCS)) [°C]

20

Partner (Association (MCS))

1-butyl-3-[5-[(3-butyl-thioureido)-methyl]-3-(4-diethylamino-2-methyl-phenylimino)-6-oxocyclohexa-1,4-dienylmethyl]-thiourea

Lee, Dong Hoon; Lee, Ho Yong; Hong, Jong-In; Tetrahedron Letters; vol. 43; nb. 40; (2002); p. 7273 - 7276, View in Reaxys 103 of 134 Description (Association Stability constant of the complex with ... (MCS)) Solvent (Association (MCS))

dimethylsulfoxide

Partner (Association (MCS))

C76H62N12O8

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Lee, Chanhyo; Lee, Dong Hoon; Hong, Jong-In; Tetrahedron Letters; vol. 42; nb. 49; (2001); p. 8665 - 8668, View in Reaxys 104 of 134 Description (Association Stability constant of the complex with ... (MCS)) Solvent (Association (MCS))

dimethylsulfoxide

Partner (Association (MCS))

C76H60N12O8(2-)*Zn(2+)

Lee, Chanhyo; Lee, Dong Hoon; Hong, Jong-In; Tetrahedron Letters; vol. 42; nb. 49; (2001); p. 8665 - 8668, View in Reaxys 105 of 134 Description (Association Stability constant of the complex with ... (MCS)) Solvent (Association (MCS))

CHCl3

Partner (Association (MCS))

C100H74N24O16

Lee, Chanhyo; Lee, Dong Hoon; Hong, Jong-In; Tetrahedron Letters; vol. 42; nb. 49; (2001); p. 8665 - 8668, View in Reaxys 106 of 134 Description (Association Formation constant of a complex (MCS)) Solvent (Association (MCS))

dimethylsulfoxide-d6

Temperature (Association (MCS)) [°C]

60

Partner (Association (MCS))

9,10-Dibutoxy-19,21-di-tert-butyl-3,5,14,16-tetraaza-tricyclo[16.3.1.07,12]docosa-1(21), 7,9,11,18(22),19-hexaene-4,15-dithione

Sasaki, Shin-ichi; Mizuno, Masaaki; Naemura, Koichiro; Tobe, Yoshito; Journal of Organic Chemistry; vol. 65; nb. 2; (2000); p. 275 - 283, View in Reaxys 107 of 134 Description (Association Formation constant of a complex (MCS)) Solvent (Association (MCS))

dimethylsulfoxide-d6

Temperature (Association (MCS)) [°C]

60

Partner (Association (MCS))

18,20-Dibutoxy-8,10-di-tert-butyl-3,5,13,15-tetraaza-tricyclo[15.3.1.17,11]docosa-1(21), 7,9,11(22),17,19-hexaene-4,14-dithione

Sasaki, Shin-ichi; Mizuno, Masaaki; Naemura, Koichiro; Tobe, Yoshito; Journal of Organic Chemistry; vol. 65; nb. 2; (2000); p. 275 - 283, View in Reaxys 108 of 134 Description (Association Formation constant of a complex (MCS)) Solvent (Association (MCS))

dimethylsulfoxide-d6

Temperature (Association (MCS)) [°C]

60

Partner (Association (MCS))

19,21-Dibutoxy-8,10-di-tert-butyl-3,5,13,15-tetraaza-tricyclo[15.2.2.17,11]docosa-1(20), 7,9,11(22),17(21),18-hexaene-4,14-dithione

Sasaki, Shin-ichi; Mizuno, Masaaki; Naemura, Koichiro; Tobe, Yoshito; Journal of Organic Chemistry; vol. 65; nb. 2; (2000); p. 275 - 283, View in Reaxys 109 of 134 Description (Association Formation constant of a complex (MCS)) Solvent (Association (MCS))

dimethylsulfoxide-d6

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Temperature (Association (MCS)) [°C]

60

Partner (Association (MCS))

16,18-Di-tert-butyl-3,5,11,13-tetraaza-bicyclo[13.3.1]nonadeca-1(18),15(19),16-triene-4,12-dithione

Sasaki, Shin-ichi; Mizuno, Masaaki; Naemura, Koichiro; Tobe, Yoshito; Journal of Organic Chemistry; vol. 65; nb. 2; (2000); p. 275 - 283, View in Reaxys 110 of 134

Description (Association Formation constant of a complex (MCS)) Solvent (Association (MCS))

dimethylsulfoxide-d6

Temperature (Association (MCS)) [°C]

60

Partner (Association (MCS))

1-[2-(16,18-di-tert-butyl-4,12-dithioxo-3,5,8,11,13-pentaaza-bicyclo[13.3.1]nonadeca-1(18),15(19),16-trien-8-yl)-ethyl]-3-(3,5-di-tert-butyl-phenyl)-thiourea

Sasaki, Shin-ichi; Mizuno, Masaaki; Naemura, Koichiro; Tobe, Yoshito; Journal of Organic Chemistry; vol. 65; nb. 2; (2000); p. 275 - 283, View in Reaxys 111 of 134

Description (Association Stability constant of the complex with ... (MCS)) Solvent (Association (MCS))

acetonitrile

Partner (Association (MCS))

5,5,10,10,15,15,20,20-octamethyl-porphyrinogene-2-carboxylic acid anthracen-1-ylamide

Miyaji, Hidekazu; Anzenbacher Jr., Pavel; Sessler, Jonathan L.; Bleasdale, Ellen R.; Gale, Philip A.; Chemical Communications; nb. 17; (1999); p. 1723 - 1724, View in Reaxys 112 of 134

Description (Association Stability constant of the complex with ... (MCS)) Solvent (Association (MCS))

dimethylsulfoxide-d6

Temperature (Association (MCS)) [°C]

60

Partner (Association (MCS))

18,20-Dibutoxy-8,10-di-tert-butyl-3,5,13,15-tetraaza-tricyclo[15.3.1.17,11]docosa-1(21), 7,9,11(22),17,19-hexaene-4,14-dithione

Tobe, Yoshito; Sasaki, Shin-Ichi; Mizuno, Masaaki; Naemura, Koichiro; Chemistry Letters; nb. 8; (1998); p. 835 836, View in Reaxys 113 of 134

Description (Association Stability constant of the complex with ... (MCS)) Solvent (Association (MCS))

dimethylsulfoxide-d6

Temperature (Association (MCS)) [°C]

60

Partner (Association (MCS))

9,10-Dibutoxy-19,21-di-tert-butyl-3,5,14,16-tetraaza-tricyclo[16.3.1.07,12]docosa-1(21), 7,9,11,18(22),19-hexaene-4,15-dithione

Tobe, Yoshito; Sasaki, Shin-Ichi; Mizuno, Masaaki; Naemura, Koichiro; Chemistry Letters; nb. 8; (1998); p. 835 836, View in Reaxys 114 of 134

Description (Association Stability constant of the complex with ... (MCS)) Solvent (Association (MCS))

dimethylsulfoxide-d6

Temperature (Association (MCS)) [°C]

60

Partner (Association (MCS))

16,18-Di-tert-butyl-3,5,11,13-tetraaza-bicyclo[13.3.1]nonadeca-1(18),15(19),16-triene-4,12-dithione

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Tobe, Yoshito; Sasaki, Shin-Ichi; Mizuno, Masaaki; Naemura, Koichiro; Chemistry Letters; nb. 8; (1998); p. 835 836, View in Reaxys 115 of 134

Description (Association Stability constant of the complex with ... (MCS)) Solvent (Association (MCS))

dimethylsulfoxide-d6

Temperature (Association (MCS)) [°C]

60

Partner (Association (MCS))

1-Butyl-3-{3-[(3-butyl-thioureido)-methyl]-benzyl}-thiourea

Tobe, Yoshito; Sasaki, Shin-Ichi; Mizuno, Masaaki; Naemura, Koichiro; Chemistry Letters; nb. 8; (1998); p. 835 836, View in Reaxys 116 of 134

Description (Association Stability constant of the complex with ... (MCS)) Solvent (Association (MCS))

benzene

Temperature (Association (MCS)) [°C]

20

Partner (Association (MCS))

4-nitro-phenol

Odashima, Kazunori; Ito, Takashi; Tohda, Koji; Umezawa, Yoshio; Chemical and Pharmaceutical Bulletin; vol. 46; nb. 8; (1998); p. 1248 - 1253, View in Reaxys 117 of 134

Description (Association Stability constant of the complex with ... (MCS)) Solvent (Association (MCS))

CD2Cl2; CD3CN

Temperature (Association (MCS)) [°C]

24.9

Comment (Association (MCS))

Ratio of solvents: 1:3 v/v

Partner (Association (MCS))

2,16,18,32,45,47-hexaethyl-5,13,21,29,34,42,44,46,48-nonaazaheptacyclo[15,15,11,13,31.17,11.115,19.123,27.136,40]-octatetraconta-1,3(45),7(48),8,10,15(47), 16,18,23(46),26,31,36,37,39-pentadecaene-6,12,22,28,35,41-hexone

Bisson; Lynch; Monahan; Anslyn; Angewandte Chemie - International Edition in English; vol. 36; nb. 21; (1997); p. 2340 - 2342, View in Reaxys 118 of 134

Description (Association Stability constant of the complex with ... (MCS)) Solvent (Association (MCS))

CD2Cl2

Temperature (Association (MCS)) [°C]

24.9

Partner (Association (MCS))

5,10,15,20,22,24-hexahydro-5,5,10,10,15,15,20,20-octamethyl-21H,23H-porphine

Gale, Philip A.; Sessler, Jonathan L.; Kral, Vladimir; Lynch, Vincent; Journal of the American Chemical Society; vol. 118; nb. 21; (1996); p. 5140 - 5141, View in Reaxys 119 of 134

Description (Association Stability constant of the complex with ... (MCS)) Solvent (Association (MCS))

dimethylsulfoxide-d6

Partner (Association (MCS))

1-Butyl-3-{3-[(3-butyl-ureido)-methyl]-benzyl}-urea

Nishizawa, Seiichi; Buehlmann, Philippe; Iwao, Masatoshi; Umezawa, Yoshio; Tetrahedron Letters; vol. 36; nb. 36; (1995); p. 6483 - 6486, View in Reaxys

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120 of 134 Description (Association Association with compound (MCS)) Solvent (Association (MCS))

dimethylsulfoxide-d6

Partner (Association (MCS))

1-Butyl-3-{3-[(3-butyl-ureido)-methyl]-benzyl}-urea

Nishizawa, Seiichi; Buehlmann, Philippe; Iwao, Masatoshi; Umezawa, Yoshio; Tetrahedron Letters; vol. 36; nb. 36; (1995); p. 6483 - 6486, View in Reaxys 121 of 134 Description (Association Association with compound (MCS)) Solvent (Association (MCS))

dimethylsulfoxide-d6

Partner (Association (MCS))

1-Butyl-3-{3-[(3-butyl-thioureido)-methyl]-benzyl}-thiourea

Nishizawa, Seiichi; Buehlmann, Philippe; Iwao, Masatoshi; Umezawa, Yoshio; Tetrahedron Letters; vol. 36; nb. 36; (1995); p. 6483 - 6486, View in Reaxys 122 of 134 Description (Association Stability constant of the complex with ... (MCS)) Solvent (Association (MCS))

dimethylsulfoxide-d6

Partner (Association (MCS))

1-Butyl-3-{3-[(3-butyl-thioureido)-methyl]-benzyl}-thiourea

Nishizawa, Seiichi; Buehlmann, Philippe; Iwao, Masatoshi; Umezawa, Yoshio; Tetrahedron Letters; vol. 36; nb. 36; (1995); p. 6483 - 6486, View in Reaxys 123 of 134 Description (Association Association with compound (MCS)) Partner (Association (MCS))

coumarin 153

Bart, E.; Meltsin, A.; Huppert, D.; Journal of Physical Chemistry; vol. 98; nb. 13; (1994); p. 3295 - 3299, View in Reaxys 124 of 134 Description (Association Further physical properties of the complex (MCS)) Partner (Association (MCS))

coumarin 102

Bart, E.; Meltsin, A.; Huppert, D.; Journal of Physical Chemistry; vol. 98; nb. 42; (1994); p. 10819 - 10823, View in Reaxys 125 of 134 Description (Association Further physical properties of the complex (MCS)) Partner (Association (MCS))

coumarin 153

Bart, E.; Meltsin, A.; Huppert, D.; Journal of Physical Chemistry; vol. 98; nb. 42; (1994); p. 10819 - 10823, View in Reaxys 126 of 134 Description (Association Further physical properties of the complex (MCS)) Partner (Association (MCS))

6-lt;N-(4-methylphenyl)aminogt;-2-naphthalene-N,N-dimethylsulfonamide

Bart, E.; Meltsin, A.; Huppert, D.; Journal of Physical Chemistry; vol. 98; nb. 42; (1994); p. 10819 - 10823, View in Reaxys 127 of 134 Description (Association Stability constant of the complex with ... (MCS)) Solvent (Association (MCS))

CDCl3

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Temperature (Association (MCS)) [°C]

24.9

Partner (Association (MCS))

25,26,27,28-Tetrakis(methoxyethoxy)-5,11,17,23-tetrakis(propylsulfamoyl)calixlt;4gt;arene

Morzherin; Rudkevich; Verboom; Reinhoudt; Journal of Organic Chemistry; vol. 58; nb. 26; (1993); p. 7602 7605, View in Reaxys 128 of 134 Description (Association Stability constant of the complex with ... (MCS)) Solvent (Association (MCS))

CDCl3

Temperature (Association (MCS)) [°C]

24.9

Partner (Association (MCS))

5,11,17,23-Tetrakislt;(1,1-dimethylethyl)sulfamoylgt;-25,26,27,28-tetrakis(methoxyethoxy)calixlt;4gt;arene

Morzherin; Rudkevich; Verboom; Reinhoudt; Journal of Organic Chemistry; vol. 58; nb. 26; (1993); p. 7602 7605, View in Reaxys 129 of 134 Description (Association Stability constant of the complex with ... (MCS)) Solvent (Association (MCS))

CDCl3

Temperature (Association (MCS)) [°C]

24.9

Partner (Association (MCS))

5,11,17,23-Tetrakislt;lt;(2-acetylamino)ethylgt;sulfamoylgt;-25,26,27,28-tetrakis(methoxyethoxy)calixlt;4gt;arene

Morzherin; Rudkevich; Verboom; Reinhoudt; Journal of Organic Chemistry; vol. 58; nb. 26; (1993); p. 7602 7605, View in Reaxys 130 of 134 Description (Association NMR spectrum of the complex (MCS)) Solvent (Association (MCS))

CDCl3

Partner (Association (MCS))

5,11,17,23-Tetrakislt;lt;(2-acetylamino)ethylgt;sulfamoylgt;-25,26,27,28-tetrakis(methoxyethoxy)calixlt;4gt;arene

Morzherin; Rudkevich; Verboom; Reinhoudt; Journal of Organic Chemistry; vol. 58; nb. 26; (1993); p. 7602 7605, View in Reaxys 131 of 134 Description (Association Further physical properties of the complex (MCS)) Partner (Association (MCS))

5,11,17,23-Tetrakislt;lt;(2-acetylamino)ethylgt;sulfamoylgt;-25,26,27,28-tetrakis(methoxyethoxy)calixlt;4gt;arene

Morzherin; Rudkevich; Verboom; Reinhoudt; Journal of Organic Chemistry; vol. 58; nb. 26; (1993); p. 7602 7605, View in Reaxys 132 of 134 Description (Association Stability constant of the complex with ... (MCS)) Solvent (Association (MCS))

CDCl3

Temperature (Association (MCS)) [°C]

24.9

Partner (Association (MCS))

N-propyl-naphthalene-2-sulfonamide

Morzherin; Rudkevich; Verboom; Reinhoudt; Journal of Organic Chemistry; vol. 58; nb. 26; (1993); p. 7602 7605, View in Reaxys 133 of 134 Description (Association Stability constant of the complex with ... (MCS))

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Solvent (Association (MCS))

CDCl3

Temperature (Association (MCS)) [°C]

24.9

Partner (Association (MCS))

N-acetyl-N'-tosylethylenediamine

Morzherin; Rudkevich; Verboom; Reinhoudt; Journal of Organic Chemistry; vol. 58; nb. 26; (1993); p. 7602 7605, View in Reaxys 134 of 134 Description (Association Association with compound (MCS)) Temperature (Association (MCS)) [°C]

25

Partner (Association (MCS))

dichloromethane

Svorstoel, Idar; Hoeiland, Harald; Songstad, Jon; Acta Chemica Scandinavica, Series B: Organic Chemistry and Biochemistry; vol. 38; nb. 10; (1984); p. 885 - 894, View in Reaxys Electrical Data (1) 1 of 1

Description (Electrical Data)

Electrical conductivity

Svorstoel, Idar; Hoeiland, Harald; Songstad, Jon; Acta Chemica Scandinavica, Series B: Organic Chemistry and Biochemistry; vol. 38; nb. 10; (1984); p. 885 - 894, View in Reaxys; Svorstoel, Idar; Songstad, Jon; Acta Chemica Scandinavica, Series B: Organic Chemistry and Biochemistry; vol. 39; nb. 8; (1985); p. 639 - 656, View in Reaxys Electrochemical Behaviour (1) Description (Elec- References trochemical Behaviour) Stability constant

Lambeau,Y. et al.; Bulletin des Societes Chimiques Belges; vol. 85; (1976); p. 129 - 135, View in Reaxys

Energy Data (MCS) (6) 1 of 6

Description (Energy Data (MCS))

Enthalpy of solution

Temperature (Energy Data (MCS)) [°C]

25

Partner (Energy Data (MCS))

methanol

Inerowicz, Halina D.; Li, Wei; Persson, Ingmar; Journal of the Chemical Society, Faraday Transactions; vol. 90; nb. 15; (1994); p. 2223 - 2234, View in Reaxys 2 of 6

Description (Energy Data (MCS))

Enthalpy of solution

Temperature (Energy Data (MCS)) [°C]

25

Partner (Energy Data (MCS))

acetonitrile

Inerowicz, Halina D.; Li, Wei; Persson, Ingmar; Journal of the Chemical Society, Faraday Transactions; vol. 90; nb. 15; (1994); p. 2223 - 2234, View in Reaxys 3 of 6

Description (Energy Data (MCS))

Enthalpy of solution

Temperature (Energy Data (MCS)) [°C]

25

Partner (Energy Data (MCS))

dimethyl sulfoxide

Inerowicz, Halina D.; Li, Wei; Persson, Ingmar; Journal of the Chemical Society, Faraday Transactions; vol. 90; nb. 15; (1994); p. 2223 - 2234, View in Reaxys 4 of 6

Description (Energy Data (MCS))

Enthalpy of solution

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Temperature (Energy Data (MCS)) [°C]

25

Partner (Energy Data (MCS))

pyridine

Inerowicz, Halina D.; Li, Wei; Persson, Ingmar; Journal of the Chemical Society, Faraday Transactions; vol. 90; nb. 15; (1994); p. 2223 - 2234, View in Reaxys 5 of 6

Description (Energy Data (MCS))

Enthalpy of solution

Temperature (Energy Data (MCS)) [°C]

25

Partner (Energy Data (MCS))

N,N-dimethylthioformamide

Inerowicz, Halina D.; Li, Wei; Persson, Ingmar; Journal of the Chemical Society, Faraday Transactions; vol. 90; nb. 15; (1994); p. 2223 - 2234, View in Reaxys 6 of 6

Description (Energy Data (MCS))

Enthalpy of solution

Temperature (Energy Data (MCS)) [°C]

25

Partner (Energy Data (MCS))

H2O

Inerowicz, Halina D.; Li, Wei; Persson, Ingmar; Journal of the Chemical Society, Faraday Transactions; vol. 90; nb. 15; (1994); p. 2223 - 2234, View in Reaxys Solubility (MCS) (2) 1 of 2

Comment (Solubility (MCS))

good solubility in CH3CN solvent

Kalita, Hemanta; Ghosh, Avijit; Lee, Way-Zen; Ravikanth, Mangalampalli; Chemistry - A European Journal; vol. 22; nb. 6; (2016); p. 2153 - 2157, View in Reaxys 2 of 2

Comment (Solubility (MCS))

soluble in water

Wang, Qing; Wu, Zhi Min; Li, Yongfei; Tan, Ying; Liu, Ning; Liu, Yuejin; RSC Advances; vol. 4; nb. 63; (2014); p. 33466 - 33473, View in Reaxys NMR Spectroscopy (2) 1 of 2

Description (NMR Spec- Spectrum troscopy) Nucleus (NMR Spectroscopy)

1H

Solvents (NMR Spectro- [D3]acetonitrile scopy) Frequency (NMR Spectroscopy) [MHz]

300

Location

supporting information

Kim, Hyun Jung; Bhuniya, Sankarprasad; Mahajan, Rakesh Kumar; Puri, Rajiv; Liu, Hongguang; Ko, Kyoung Chul; Lee, Jin Yong; Kim, Jong Seung; Chemical Communications; nb. 46; (2009); p. 7128 - 7130, View in Reaxys 2 of 2

Description (NMR Spec- Spin-lattice relaxation time (T1) troscopy) Nucleus (NMR Spectroscopy)

1H

Kleinpeter, Erich; Holzberger, Anja; Tetrahedron; vol. 62; nb. 43; (2006); p. 10237 - 10247, View in Reaxys Mass Spectrometry (1) Comment (Mass References Spectrometry) FAB (fast atom bombardment)

Furton, Kenneth G.; Poole, Colin F.; Organic Mass Spectrometry; vol. 22; (1987); p. 377 - 378, View in Reaxys

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Raman Spectroscopy (1) Description (Ram- References an Spectroscopy) Spectrum

Lambeau,Y. et al.; Bulletin des Societes Chimiques Belges; vol. 85; (1976); p. 129 - 135, View in Reaxys

Use (12) Use Pattern

Location

References

phase transfer catalyst for demethylation reaction

Patent; IND-SWIFT LABORATORIES LIMITED; WO2009/84038; (2009); (A2) English, View in Reaxys

phase transfer catalyst for Odesmeylvenlafaxine preparation

Patent; MATRIX LABORATORIES LIMITED; WO2009/84039; (2009); (A2) English, View in Reaxys

phase transfer catalyst for the alkoxylation of halopyrimidine with alcohol in the process for manufacture of bosentan and related compounds

Patent; ACTAVIS GROUP PTC EHF; WO2009/112954; (2009); (A2) English, View in Reaxys

phase transfer catalyst for the sulfoamidation of halopyrimidine with benzene sulfonamide in the process for manufacture of bosentan and related compounds

Patent; ACTAVIS GROUP PTC EHF; WO2009/112954; (2009); (A2) English, View in Reaxys

phase transfer catalyst for conversion of hydroxypyrimidine into alkoxypyrimidine in the process for manufacture of bosentan and related compounds

Patent; ACTAVIS GROUP PTC EHF; WO2009/112954; (2009); (A2) English, View in Reaxys

Phase transfer catalyst

Patent; TEVA PHARMACEUTICAL INDUSTRIES LTD.; TEVA PHARMACEUTICALS USA, INC.; WO2006/44648; (2006); (A1) English, View in Reaxys; Patent; ASTRAZENECA AB; WO2008/30160; (2008); (A1) English, View in Reaxys; Patent; IND-SWIFT LABORATORIES LIMITED; WO2008/47388; (2008); (A2) English, View in Reaxys

phase transfer catalyst

Patent; JUBILANT ORGANOSYS LIMITED; WO2006/70396; (2006); (A1) English, View in Reaxys; Patent; Dianoczki, Csilla; Kovari, Jozsefne; Novak, Lajos; Poppe, Laszlo; Recseg, Katalin; US2007/78274; (2007); (A1) English, View in Reaxys

transfer catalyst for making polymer nanocomposites

Page/Page column 2; 4

Patent; Ramanathan, Lalgudi S.; Vijayendran, Bhima R.; Schulte, Michael D.; Hardaker, Stephen S.; Gupta, Abhishek; Elhard, Joel D.; Hardaker, Angela; US2007/293611; (2007); (A1) English, View in Reaxys

phase-transfer catalyst

Patent; FERRER INTERNACIONAL, S. A.; WO2006/100226; (2006); (A1) English, View in Reaxys

Phase-transfer catalyst

Patent; BAYER CROPSCIENCE AG; WO2006/24402; (2006); (A1) German, View in Reaxys

Phase transfer catalyst for production of sulfamoyltriazoles

Patent; NISSAN CHEMICAL INDUSTRIES, LTD.; WO2006/57354; (2006); (A1) Japanese, View in Reaxys

Copyright © 2018 Reed Elsevier Properties SA. All rights reserved. Authorized use only. Reaxys® and the Reaxys® trademark are owned and protected by Reed Elsevier Properties SA and used under license.

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phase transfer catalyst for the synthesis of 1-[2(2,4-difluorophenyl)-oxiranylmethyl]-1H-1,2,4-triazole

Patent; Valluri, Sudhakar; Mohanty, Sandeep; Devireddy, Chandra Mohan Reddy; Talasila, Srinivasa Rao; US2006/252940; (2006); (A1) English, View in Reaxys

Medchem (23) 1 of 23

Bioassay Category

In Vitro (Efficacy)

Bioassay Name

In Vitro (others)

Bioassay Details

Effect : |transport Target : human placental syncytial microvillus membrane vesiclesBioassay : in vitro; effect on choline uptake assayed; 250 μM <3H>choline; 100 mM mannitol; 100 mM KCl; 20 μM valinomycin; Hepes-Tris, pH 7.4; 37 deg C; rapid filtration technique

Substance RN

3599663View in Reaxys

Substance Name

1479123

Substance Dose

1 mM

Qualitative Results

title comp. inhibited <3H>choline uptake; graphical representation

Measurement Parameter

Qualitative

Van Der AA; Wouterse; Peereboom-Stegeman; Russel; Biochemical Pharmacology; vol. 50; nb. 11; (1995); p. 1873 - 1878, View in Reaxys 2 of 23

Bioassay Category

In Vitro (Efficacy)

Bioassay Name

In Vitro (others)

Bioassay Details

Effect : |agonist Target : New Zealand White rabbit carotid arteryBioassay : force displacement transducer; Grass polygraph; rings contracted with phenylephrine (1μM); concentration-response curve; effect on L-NAME (30μM)/indomethacin (10μM) insensitive relaxation to acethylcholine (ACh) rabbits (1-2 kg) killed by exsanguination; common carotid artery quickly excised, adherent fat and connective tissue removed, cut into 5 mm rings; pretreatment with title compound (K+ channel blocker)

Substance RN

3599663View in Reaxys

Substance Name

1479123

Substance Dose

1 mM

Qualitative Results

title compound completely inhibited L-NAME/indomethacin insensitive response to ACh

Measurement Parameter

Qualitative

Dong, Hui; Waldron, Gareth J.; Galipeau, Denise; Cole, William C.; Triggle, Christopher R.; British Journal of Pharmacology; vol. 120; nb. 4; (1997); p. 695 - 701, View in Reaxys 3 of 23

Bioassay Category

In Vitro (Efficacy)

Bioassay Details

Minimum inhibitory concentration of the compound against Staphylococcus epidermidis ATCC12228 upon incubation for 24 h at 37 degree C

Biological Species/NCBI Staphylococcus epidermidis ATCC 12228 ID Substance RN

3599663View in Reaxys

Qualitative Results

MIC not calculated

Measurement Parameter

Qualitative

Measurement Object

MIC

Ingalsbe, Michelle L.; Denis, Jeffrey D.St.; McGahan, Megan E.; Steiner, Walter W.; Priefer, Ronny; Bioorganic and Medicinal Chemistry Letters; vol. 19; nb. 17; (2009); p. 4984 - 4987, View in Reaxys 4 of 23

Bioassay Category

In Vitro (Efficacy)

Bioassay Details

Antimicrobial efficacy expressed as ratio of reciprocal of y-intercept as maximum zone of inhibition to that of negative reciprocal of x-intercept as concentration to one-half maxi-

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mum zone of inhibition against Staphylococcus epidermidis ATCC12228 upon incubation for 24 h at 37 degree C with compound dissolved in DMSO by halo test Biological Species/NCBI Staphylococcus epidermidis ATCC 12228 ID Substance RN

3599663View in Reaxys

Qualitative Results

Antimicrobial efficacy not calculated

Measurement Parameter

Qualitative

Measurement Object

Antimicrobial efficacy

Ingalsbe, Michelle L.; Denis, Jeffrey D.St.; McGahan, Megan E.; Steiner, Walter W.; Priefer, Ronny; Bioorganic and Medicinal Chemistry Letters; vol. 19; nb. 17; (2009); p. 4984 - 4987, View in Reaxys 5 of 23

Bioassay Category

In Vitro (Efficacy)

Bioassay Details

Minimum inhibitory concentration of the compound against Escherichia coli K-12 C600 upon incubation for 24 h at 37 degree C

Biological Species/NCBI Escherichia coli K 12 C600 ID Substance RN

3599663View in Reaxys

Qualitative Results

MIC not calculated

Measurement Parameter

Qualitative

Measurement Object

MIC

Ingalsbe, Michelle L.; Denis, Jeffrey D.St.; McGahan, Megan E.; Steiner, Walter W.; Priefer, Ronny; Bioorganic and Medicinal Chemistry Letters; vol. 19; nb. 17; (2009); p. 4984 - 4987, View in Reaxys 6 of 23

Bioassay Category

In Vitro (Efficacy)

Bioassay Details

Antimicrobial efficacy expressed as ratio of reciprocal of y-intercept as maximum zone of inhibition to that of negative reciprocal of x-intercept as concentration to one-half maximum zone of inhibition against Escherichia coli K-12 C600 upon incubation for 24 h at 37 degree C with compound dissolved in DMSO by halo test

Biological Species/NCBI Escherichia coli K 12 C600 ID Substance RN

3599663View in Reaxys

Qualitative Results

Antimicrobial efficacy not calculated

Measurement Parameter

Qualitative

Measurement Object

Antimicrobial efficacy

Ingalsbe, Michelle L.; Denis, Jeffrey D.St.; McGahan, Megan E.; Steiner, Walter W.; Priefer, Ronny; Bioorganic and Medicinal Chemistry Letters; vol. 19; nb. 17; (2009); p. 4984 - 4987, View in Reaxys 7 of 23

Bioassay Category

In Vitro (Efficacy)

Bioassay Details

Effect of the compound (2.0 ug/ml) on the cell morphology of Candida albicans under hyphal growth condition (SPG medium) at dilution 32 upon incubation for 24 h in PBS, pH 5.0

Biological Species/NCBI Candida albicans ID Substance RN

3599663View in Reaxys

Qualitative Results

H = Hyphae

Measurement Object

Effect on cell morphology

Concomitants: Compound name

PBS

Concomitants: Compound role

COM

Copyright © 2018 Reed Elsevier Properties SA. All rights reserved. Authorized use only. Reaxys® and the Reaxys® trademark are owned and protected by Reed Elsevier Properties SA and used under license.

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Watanabe, Hiroshi; Azuma, Masayuki; Igarashi, Koicbi; Ooshima, Hiroshi; Journal of Antibiotics; vol. 59; nb. 5; (2006); p. 281 - 287, View in Reaxys 8 of 23

Bioassay Category

In Vitro (Efficacy)

Bioassay Details

Effect of the compound (2.0 ug/ml) on the cell morphology of Candida albicans under hyphal growth condition (SPG medium) at dilution 4 upon incubation for 24 h in PBS, pH 5.0

Biological Species/NCBI Candida albicans ID Substance RN

3599663View in Reaxys

Qualitative Results

Y = chain of yeast cells

Watanabe, Hiroshi; Azuma, Masayuki; Igarashi, Koicbi; Ooshima, Hiroshi; Journal of Antibiotics; vol. 59; nb. 5; (2006); p. 281 - 287, View in Reaxys 9 of 23

Bioassay Category

In Vitro (Efficacy)

Bioassay Details

Effect of the compound (2.0 ug/ml) on the cell morphology of Candida albicans under hyphal growth condition (SPG medium) at dilution 256 upon incubation for 24 h in PBS, pH 5.0

Biological Species/NCBI Candida albicans ID Substance RN

3599663View in Reaxys

Qualitative Results

H = Hyphae

Measurement Object

Effect on cell morphology

Concomitants: Compound name

PBS

Concomitants: Compound role

COM

Watanabe, Hiroshi; Azuma, Masayuki; Igarashi, Koicbi; Ooshima, Hiroshi; Journal of Antibiotics; vol. 59; nb. 5; (2006); p. 281 - 287, View in Reaxys 10 of 23

Bioassay Category

In Vitro (Efficacy)

Bioassay Details

Effect of the compound (2.0 ug/ml) on the cell morphology of Candida albicans under hyphal growth condition (SPG medium) at dilution 1024 upon incubation for 24 h in PBS, pH 5.0

Biological Species/NCBI Candida albicans ID Substance RN

3599663View in Reaxys

Qualitative Results

H = Hyphae

Measurement Object

Cell morphology

Watanabe, Hiroshi; Azuma, Masayuki; Igarashi, Koicbi; Ooshima, Hiroshi; Journal of Antibiotics; vol. 59; nb. 5; (2006); p. 281 - 287, View in Reaxys 11 of 23

Bioassay Category

In Vitro (Efficacy)

Bioassay Details

Effect of the compound (2.0 ug/ml) on the cell morphology of Candida albicans under hyphal growth condition (SPG medium) at dilution 64 upon incubation for 24 h in PBS, pH 5.0

Biological Species/NCBI Candida albicans ID Substance RN

3599663View in Reaxys

Qualitative Results

H = Hyphae

Watanabe, Hiroshi; Azuma, Masayuki; Igarashi, Koicbi; Ooshima, Hiroshi; Journal of Antibiotics; vol. 59; nb. 5; (2006); p. 281 - 287, View in Reaxys 12 of 23

Bioassay Category

In Vitro (Efficacy)

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Bioassay Details

Effect of the compound (2.0 ug/ml) on the cell morphology of Candida albicans under hyphal growth condition (SPG medium) at dilution 512 upon incubation for 24 h in PBS, pH 5.0

Biological Species/NCBI Candida albicans ID Substance RN

3599663View in Reaxys

Qualitative Results

H = Hyphae

Measurement Object

Cell morphology

Watanabe, Hiroshi; Azuma, Masayuki; Igarashi, Koicbi; Ooshima, Hiroshi; Journal of Antibiotics; vol. 59; nb. 5; (2006); p. 281 - 287, View in Reaxys 13 of 23

Bioassay Category

In Vitro (Efficacy)

Bioassay Details

Effect of the compound (2.0 ug/ml) on the cell morphology of Candida albicans under hyphal growth condition (SPG medium) at dilution 1 upon incubation for 24 h in PBS, pH 5.0

Biological Species/NCBI Candida albicans ID Substance RN

3599663View in Reaxys

Qualitative Results

N = No growth

Measurement Object

Effect on cell morphology

Concomitants: Compound name

PBS

Concomitants: Compound role

COM

Watanabe, Hiroshi; Azuma, Masayuki; Igarashi, Koicbi; Ooshima, Hiroshi; Journal of Antibiotics; vol. 59; nb. 5; (2006); p. 281 - 287, View in Reaxys 14 of 23

Bioassay Category

In Vitro (Efficacy)

Bioassay Details

Effect of the compound (2.0 ug/ml) on the cell morphology of Candida albicans under hyphal growth condition (SPG medium) at dilution 16 upon incubation for 24 h in PBS, pH 5.0

Biological Species/NCBI Candida albicans ID Substance RN

3599663View in Reaxys

Qualitative Results

H = Hyphae

Measurement Object

Cell morphology

Watanabe, Hiroshi; Azuma, Masayuki; Igarashi, Koicbi; Ooshima, Hiroshi; Journal of Antibiotics; vol. 59; nb. 5; (2006); p. 281 - 287, View in Reaxys 15 of 23

Bioassay Category

In Vitro (Efficacy)

Bioassay Details

Effect of the compound (2.0 ug/ml) on the cell morphology of Candida albicans under hyphal growth condition (SPG medium) at dilution 2 upon incubation for 24 h in PBS, pH 5.0

Biological Species/NCBI Candida albicans ID Substance RN

3599663View in Reaxys

Qualitative Results

Y = chain of yeast cells

Watanabe, Hiroshi; Azuma, Masayuki; Igarashi, Koicbi; Ooshima, Hiroshi; Journal of Antibiotics; vol. 59; nb. 5; (2006); p. 281 - 287, View in Reaxys 16 of 23

Bioassay Category

In Vitro (Efficacy)

Bioassay Details

Effect of the compound (2.0 ug/ml) on the cell morphology of Candida albicans under hyphal growth condition (SPG medium) at dilution 8 upon incubation for 24 h in PBS, pH 5.0

Biological Species/NCBI Candida albicans ID Substance RN

3599663View in Reaxys

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2018-03-20 12:57:23


Qualitative Results

Y = chain of yeast cells

Measurement Object

Cell morphology

Watanabe, Hiroshi; Azuma, Masayuki; Igarashi, Koicbi; Ooshima, Hiroshi; Journal of Antibiotics; vol. 59; nb. 5; (2006); p. 281 - 287, View in Reaxys 17 of 23

Bioassay Category

In Vitro (Efficacy)

Bioassay Details

Effect of the compound (2.0 ug/ml) on the cell morphology of Candida albicans under hyphal growth condition (SPG medium) at dilution 128 upon incubation for 24 h in PBS, pH 5.0

Biological Species/NCBI Candida albicans ID Substance RN

3599663View in Reaxys

Qualitative Results

H = Hyphae

Measurement Object

Effect on cell morphology

Concomitants: Compound name

PBS

Concomitants: Compound role

COM

Watanabe, Hiroshi; Azuma, Masayuki; Igarashi, Koicbi; Ooshima, Hiroshi; Journal of Antibiotics; vol. 59; nb. 5; (2006); p. 281 - 287, View in Reaxys 18 of 23

Target Name

Carboxylesterase 1 [human]

Target Synonyms

carboxylesterase 1

Target, Subunit, Species Carboxylesterase 1 [human]

19 of 23

Target Mutant/Chimera Details

Carboxylesterase 1 [human]:Wild

Target Species (Bioactivity)

human

Target Transfection

Transfected

Bioassay Category

Metabolism/Transport

Bioassay Name

Enzymology inhibition

Cells/Cell Lines

Sf21 cell line

Substance RN

3599663View in Reaxys

Substance Name

tetrabutylammonium hydrogen sulfate

Substance Dose

100 µM

Measurement Parameter

% Inhibition

Unit

%

Quantitative value

1

Measurement pX

1

Concomitants: Compound RN

1281877

Concomitants: Compound name

4-Nitrophenyl acetate

Concomitants: Compound role

SUB

Target Name

Carboxylesterase 2 [human]

Target Synonyms

carboxylesterase 2

Target, Subunit, Species Carboxylesterase 2 [human]

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20 of 23

Target Mutant/Chimera Details

Carboxylesterase 2 [human]:Wild

Target Species (Bioactivity)

human

Target Transfection

Transfected

Bioassay Category

Metabolism/Transport

Bioassay Name

Enzymology inhibition

Cells/Cell Lines

Sf21 cell line

Substance RN

3599663View in Reaxys

Substance Name

tetrabutylammonium hydrogen sulfate

Substance Dose

100 µM

Measurement Parameter

% Inhibition

Unit

%

Quantitative value

19

Measurement pX

1

Concomitants: Compound RN

1281877

Concomitants: Compound name

4-Nitrophenyl acetate

Concomitants: Compound role

SUB

Target Name

Arylacetamide deacetylase [human]

Target Synonyms

aadac; arylacetamide deacetylase; dac

Target Uniprot ID

p22760

Target, Subunit, Species Arylacetamide deacetylase [human] Target Mutant/Chimera Details

Arylacetamide deacetylase [human]:Wild

Target Species (Bioactivity)

human

Target Transfection

Transfected

Bioassay Category

In Vitro (Efficacy)

Bioassay Name

Enzymology inhibition

Cells/Cell Lines

Sf21 cell line

Substance RN

3599663View in Reaxys

Substance Name

tetrabutylammonium hydrogen sulfate

Substance Dose

100 µM

Measurement Parameter

% Inhibition

Unit

%

Quantitative value

12

Measurement pX

1

Concomitants: Compound RN

1281877

Concomitants: Compound name

4-Nitrophenyl acetate

Copyright © 2018 Reed Elsevier Properties SA. All rights reserved. Authorized use only. Reaxys® and the Reaxys® trademark are owned and protected by Reed Elsevier Properties SA and used under license.

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21 of 23

Concomitants: Compound role

SUB

Target Name

UDP-glucuronosyltransferase 1-8

Target Synonyms

a3 (udp-glucuronosyltransferase 1-8); gnt1 (udp-glucuronosyltransferase 1-8); lugp4; udpglucuronosyltransferase 1-10; udp-glucuronosyltransferase 1-7 (udp-glucuronosyltransferase 1-8); udp-glucuronosyltransferase 1-8; udp-glucuronosyltransferase 1-9; udp-glucuronosyltransferase 1-g; udp-glucuronosyltransferase 1-h; udp-glucuronosyltransferase 1-i; udp-glucuronosyltransferase 1-j; udp-glucuronosyltransferase 1a10; udp-glucuronosyltransferase 1a7; udp-glucuronosyltransferase 1a8; udp-glucuronosyltransferase 1a9; udpgt; udpgt 1-10; udpgt 1-7; udpgt 1-8; udpgt 1-9; ugt-1g; ugt-1h; ugt-1i; ugt-1j; ugt1 (udp-glucuronosyltransferase 1-8); ugt1*10; ugt1*7; ugt1*8; ugt1*9; ugt1-07; ugt1-08; ugt1-09; ugt1-10; ugt1.10; ugt1.7; ugt1.8; ugt1.9; ugt1a10 (udp-glucuronosyltransferase 1-8); ugt1a12; ugt1a7 (udp-glucuronosyltransferase 1-8); ugt1a8; ugt1a9; ugt1g; ugt1h; ugt1i; ugt1j; ugtp4

Target, Subunit, Species UDP-glucuronosyltransferase 1-8 Target Mutant/Chimera Details

UDP-glucuronosyltransferase 1-8:Wild

Target Transfection

Transfected

Substance Action on Target

Inhibitor

Bioassay Category

In Vitro (Efficacy)

Substance RN

3599663View in Reaxys

Substance Name

tetrabutylammonium hydrogensulfate

Substance Dose

20 μM

Measurement Parameter

% Inhibition

Unit

%

Quantitative value

0

Measurement pX

1

Concomitants: Compound RN

4890356; 78881

Concomitants: Compound role

SUB; COM

Oda, Shingo; Fujiwara, Ryoichi; Kutsuno, Yuki; Fukami, Tatsuki; Itoh, Tomoo; Yokoi, Tsuyoshi; Nakajima, Miki; Drug Metabolism and Disposition; vol. 43; nb. 6; (2015); p. 812 - 818, View in Reaxys 22 of 23

Target Name

UDP-glucuronosyltransferase 1-8

Target Synonyms

a3 (udp-glucuronosyltransferase 1-8); gnt1 (udp-glucuronosyltransferase 1-8); lugp4; udpglucuronosyltransferase 1-10; udp-glucuronosyltransferase 1-7 (udp-glucuronosyltransferase 1-8); udp-glucuronosyltransferase 1-8; udp-glucuronosyltransferase 1-9; udp-glucuronosyltransferase 1-g; udp-glucuronosyltransferase 1-h; udp-glucuronosyltransferase 1-i; udp-glucuronosyltransferase 1-j; udp-glucuronosyltransferase 1a10; udp-glucuronosyltransferase 1a7; udp-glucuronosyltransferase 1a8; udp-glucuronosyltransferase 1a9; udpgt; udpgt 1-10; udpgt 1-7; udpgt 1-8; udpgt 1-9; ugt-1g; ugt-1h; ugt-1i; ugt-1j; ugt1 (udp-glucuronosyltransferase 1-8); ugt1*10; ugt1*7; ugt1*8; ugt1*9; ugt1-07; ugt1-08; ugt1-09; ugt1-10; ugt1.10; ugt1.7; ugt1.8; ugt1.9; ugt1a10 (udp-glucuronosyltransferase 1-8); ugt1a12; ugt1a7 (udp-glucuronosyltransferase 1-8); ugt1a8; ugt1a9; ugt1g; ugt1h; ugt1i; ugt1j; ugtp4

Target, Subunit, Species UDP-glucuronosyltransferase 1-8 Target Mutant/Chimera Details

UDP-glucuronosyltransferase 1-8:Wild

Target Transfection

Transfected

Substance Action on Target

Inhibitor

Bioassay Category

In Vitro (Efficacy)

Copyright © 2018 Reed Elsevier Properties SA. All rights reserved. Authorized use only. Reaxys® and the Reaxys® trademark are owned and protected by Reed Elsevier Properties SA and used under license.

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2018-03-20 12:57:23


Substance RN

3599663View in Reaxys

Substance Name

tetrabutylammonium hydrogensulfate

Substance Dose

20 μM

Measurement Parameter

% Inhibition

Unit

%

Quantitative value

0

Measurement pX

1

Concomitants: Compound RN

4890356; 78881

Concomitants: Compound role

SUB; COM

Oda, Shingo; Fujiwara, Ryoichi; Kutsuno, Yuki; Fukami, Tatsuki; Itoh, Tomoo; Yokoi, Tsuyoshi; Nakajima, Miki; Drug Metabolism and Disposition; vol. 43; nb. 6; (2015); p. 812 - 818, View in Reaxys 23 of 23

Target Name

UDP-glucuronosyltransferase 1-8

Target Synonyms

a3 (udp-glucuronosyltransferase 1-8); gnt1 (udp-glucuronosyltransferase 1-8); lugp4; udpglucuronosyltransferase 1-10; udp-glucuronosyltransferase 1-7 (udp-glucuronosyltransferase 1-8); udp-glucuronosyltransferase 1-8; udp-glucuronosyltransferase 1-9; udp-glucuronosyltransferase 1-g; udp-glucuronosyltransferase 1-h; udp-glucuronosyltransferase 1-i; udp-glucuronosyltransferase 1-j; udp-glucuronosyltransferase 1a10; udp-glucuronosyltransferase 1a7; udp-glucuronosyltransferase 1a8; udp-glucuronosyltransferase 1a9; udpgt; udpgt 1-10; udpgt 1-7; udpgt 1-8; udpgt 1-9; ugt-1g; ugt-1h; ugt-1i; ugt-1j; ugt1 (udp-glucuronosyltransferase 1-8); ugt1*10; ugt1*7; ugt1*8; ugt1*9; ugt1-07; ugt1-08; ugt1-09; ugt1-10; ugt1.10; ugt1.7; ugt1.8; ugt1.9; ugt1a10 (udp-glucuronosyltransferase 1-8); ugt1a12; ugt1a7 (udp-glucuronosyltransferase 1-8); ugt1a8; ugt1a9; ugt1g; ugt1h; ugt1i; ugt1j; ugtp4

Target, Subunit, Species UDP-glucuronosyltransferase 1-8 Target Mutant/Chimera Details

UDP-glucuronosyltransferase 1-8:Wild

Target Transfection

Transfected

Substance Action on Target

Inhibitor

Bioassay Category

In Vitro (Efficacy)

Substance RN

3599663View in Reaxys

Substance Name

tetrabutylammonium hydrogensulfate

Substance Dose

20 μM

Measurement Parameter

% Inhibition

Unit

%

Quantitative value

0

Measurement pX

1

Concomitants: Compound RN

4890356; 78881

Concomitants: Compound role

SUB; COM

Oda, Shingo; Fujiwara, Ryoichi; Kutsuno, Yuki; Fukami, Tatsuki; Itoh, Tomoo; Yokoi, Tsuyoshi; Nakajima, Miki; Drug Metabolism and Disposition; vol. 43; nb. 6; (2015); p. 812 - 818, View in Reaxys

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