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2,4-Bis(4-chloro­benzo­yl)-1-(4-chloro­phen­yl)-3,5-di-2-thienylcyclo­hexa­nol methanol hemisolvate

The title compound, C(34)H(25)Cl(3)O(3)S(2)·0.5CH(3)OH, was synthesized by the reaction of thio­phene-2-carbaldehyde with acetophenone and NaOH under solvent-free conditions, using tetra­butylammonium bromide as a phase-transfer catalyst. The central six-membered ring adopts a chair conformation wit...

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Detalles Bibliográficos
Autores principales: Wang, Xiao-Fang, Huang, Xian-Qiang
Formato: Texto
Lenguaje:English
Publicado: International Union of Crystallography 2008
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC2961125/
https://www.ncbi.nlm.nih.gov/pubmed/21202270
http://dx.doi.org/10.1107/S1600536808008428
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author Wang, Xiao-Fang
Huang, Xian-Qiang
author_facet Wang, Xiao-Fang
Huang, Xian-Qiang
author_sort Wang, Xiao-Fang
collection PubMed
description The title compound, C(34)H(25)Cl(3)O(3)S(2)·0.5CH(3)OH, was synthesized by the reaction of thio­phene-2-carbaldehyde with acetophenone and NaOH under solvent-free conditions, using tetra­butylammonium bromide as a phase-transfer catalyst. The central six-membered ring adopts a chair conformation with the bulky thio­phene, 4-chloro­phenyl and 4-chloro­benzoyl substituents in equatorial positions. The hydroxyl group is in an axial position and forms an intra­molecular O—H⋯O hydrogen bond to the carbonyl group of an adjacent 4-chloro­benzoyl substituent. The methanol solvent mol­ecules are disordered equally over two positions within one-dimensional channels, with site occupancy factors of 0.25.
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spelling pubmed-29611252010-12-30 2,4-Bis(4-chloro­benzo­yl)-1-(4-chloro­phen­yl)-3,5-di-2-thienylcyclo­hexa­nol methanol hemisolvate Wang, Xiao-Fang Huang, Xian-Qiang Acta Crystallogr Sect E Struct Rep Online Organic Papers The title compound, C(34)H(25)Cl(3)O(3)S(2)·0.5CH(3)OH, was synthesized by the reaction of thio­phene-2-carbaldehyde with acetophenone and NaOH under solvent-free conditions, using tetra­butylammonium bromide as a phase-transfer catalyst. The central six-membered ring adopts a chair conformation with the bulky thio­phene, 4-chloro­phenyl and 4-chloro­benzoyl substituents in equatorial positions. The hydroxyl group is in an axial position and forms an intra­molecular O—H⋯O hydrogen bond to the carbonyl group of an adjacent 4-chloro­benzoyl substituent. The methanol solvent mol­ecules are disordered equally over two positions within one-dimensional channels, with site occupancy factors of 0.25. International Union of Crystallography 2008-04-02 /pmc/articles/PMC2961125/ /pubmed/21202270 http://dx.doi.org/10.1107/S1600536808008428 Text en © Wang and Huang 2008 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
Wang, Xiao-Fang
Huang, Xian-Qiang
2,4-Bis(4-chloro­benzo­yl)-1-(4-chloro­phen­yl)-3,5-di-2-thienylcyclo­hexa­nol methanol hemisolvate
title 2,4-Bis(4-chloro­benzo­yl)-1-(4-chloro­phen­yl)-3,5-di-2-thienylcyclo­hexa­nol methanol hemisolvate
title_full 2,4-Bis(4-chloro­benzo­yl)-1-(4-chloro­phen­yl)-3,5-di-2-thienylcyclo­hexa­nol methanol hemisolvate
title_fullStr 2,4-Bis(4-chloro­benzo­yl)-1-(4-chloro­phen­yl)-3,5-di-2-thienylcyclo­hexa­nol methanol hemisolvate
title_full_unstemmed 2,4-Bis(4-chloro­benzo­yl)-1-(4-chloro­phen­yl)-3,5-di-2-thienylcyclo­hexa­nol methanol hemisolvate
title_short 2,4-Bis(4-chloro­benzo­yl)-1-(4-chloro­phen­yl)-3,5-di-2-thienylcyclo­hexa­nol methanol hemisolvate
title_sort 2,4-bis(4-chloro­benzo­yl)-1-(4-chloro­phen­yl)-3,5-di-2-thienylcyclo­hexa­nol methanol hemisolvate
topic Organic Papers
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC2961125/
https://www.ncbi.nlm.nih.gov/pubmed/21202270
http://dx.doi.org/10.1107/S1600536808008428
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