Ethyl 1-sec-butyl-2-(2-hydroxy­phen­yl)-1H-benzimidazole-5-carboxyl­ate 0.25-hydrate

In the title compound, C(20)H(22)N(2)O(3)·0.25H(2)O, the water mol­ecule (occupancy 0.25) is disordered across a crystallographic inversion center. The dihedral angle between the hydroxy­phenyl ring and the benzimidazole ring system is 59.31 (9)°. In the crystal structure, mol­ecules are connected b...

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Autores principales: Arumugam, Natarajan, Abdul Rahim, Aisyah Saad, Osman, Hasnah, Hemamalini, Madhukar, Fun, Hoong-Kun
Formato: Texto
Lenguaje:English
Publicado: International Union of Crystallography 2010
Materias:
Organic Papers
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC2979540/
https://www.ncbi.nlm.nih.gov/pubmed/21579384
http://dx.doi.org/10.1107/S1600536810015448
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author Arumugam, Natarajan
Abdul Rahim, Aisyah Saad
Osman, Hasnah
Hemamalini, Madhukar
Fun, Hoong-Kun
author_facet Arumugam, Natarajan
Abdul Rahim, Aisyah Saad
Osman, Hasnah
Hemamalini, Madhukar
Fun, Hoong-Kun
author_sort Arumugam, Natarajan
collection PubMed
description In the title compound, C(20)H(22)N(2)O(3)·0.25H(2)O, the water mol­ecule (occupancy 0.25) is disordered across a crystallographic inversion center. The dihedral angle between the hydroxy­phenyl ring and the benzimidazole ring system is 59.31 (9)°. In the crystal structure, mol­ecules are connected by inter­molecular O—H⋯N and C—H⋯O hydrogen bonds. The crystal structure is further stabilized by a weak C—H⋯π inter­action involving the imidazole ring.
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spelling pubmed-29795402010-12-30 Ethyl 1-sec-butyl-2-(2-hydroxy­phen­yl)-1H-benzimidazole-5-carboxyl­ate 0.25-hydrate Arumugam, Natarajan Abdul Rahim, Aisyah Saad Osman, Hasnah Hemamalini, Madhukar Fun, Hoong-Kun Acta Crystallogr Sect E Struct Rep Online Organic Papers In the title compound, C(20)H(22)N(2)O(3)·0.25H(2)O, the water mol­ecule (occupancy 0.25) is disordered across a crystallographic inversion center. The dihedral angle between the hydroxy­phenyl ring and the benzimidazole ring system is 59.31 (9)°. In the crystal structure, mol­ecules are connected by inter­molecular O—H⋯N and C—H⋯O hydrogen bonds. The crystal structure is further stabilized by a weak C—H⋯π inter­action involving the imidazole ring. International Union of Crystallography 2010-05-08 /pmc/articles/PMC2979540/ /pubmed/21579384 http://dx.doi.org/10.1107/S1600536810015448 Text en © Arumugam et al. 2010 http://creativecommons.org/licenses/by/2.0/uk/ This is an open-access article distributed under the terms of the Creative Commons Attribution Licence, which permits unrestricted use, distribution, and reproduction in any medium, provided the original authors and source are cited.
spellingShingle Organic Papers
Arumugam, Natarajan
Abdul Rahim, Aisyah Saad
Osman, Hasnah
Hemamalini, Madhukar
Fun, Hoong-Kun
Ethyl 1-sec-butyl-2-(2-hydroxy­phen­yl)-1H-benzimidazole-5-carboxyl­ate 0.25-hydrate
title Ethyl 1-sec-butyl-2-(2-hydroxy­phen­yl)-1H-benzimidazole-5-carboxyl­ate 0.25-hydrate
title_full Ethyl 1-sec-butyl-2-(2-hydroxy­phen­yl)-1H-benzimidazole-5-carboxyl­ate 0.25-hydrate
title_fullStr Ethyl 1-sec-butyl-2-(2-hydroxy­phen­yl)-1H-benzimidazole-5-carboxyl­ate 0.25-hydrate
title_full_unstemmed Ethyl 1-sec-butyl-2-(2-hydroxy­phen­yl)-1H-benzimidazole-5-carboxyl­ate 0.25-hydrate
title_short Ethyl 1-sec-butyl-2-(2-hydroxy­phen­yl)-1H-benzimidazole-5-carboxyl­ate 0.25-hydrate
title_sort ethyl 1-sec-butyl-2-(2-hydroxy­phen­yl)-1h-benzimidazole-5-carboxyl­ate 0.25-hydrate
topic Organic Papers
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC2979540/
https://www.ncbi.nlm.nih.gov/pubmed/21579384
http://dx.doi.org/10.1107/S1600536810015448
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