5-Cyclo­hexyl-2-(2-fluoro­phen­yl)-3-methyl­sulfinyl-1-benzo­furan

In the title compound, C(21)H(21)FO(2)S, the cyclo­hexyl ring adopts a chair conformation. The 2-fluoro­benzene ring makes a dihedral angle of 38.68 (6)° with the mean plane [r.m.s. deviation = 0.018 (2) Å] of the benzo­furan fragment. In the crystal, mol­ecules are linked by pairs of C—H⋯O hydrogen...

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Detalles Bibliográficos
Autores principales: Choi, Hong Dae, Seo, Pil Ja, Lee, Uk
Formato: Online Artículo Texto
Lenguaje:English
Publicado: International Union of Crystallography 2013
Materias:
Organic Papers
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3685044/
https://www.ncbi.nlm.nih.gov/pubmed/23795063
http://dx.doi.org/10.1107/S1600536813012701
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author Choi, Hong Dae
Seo, Pil Ja
Lee, Uk
author_facet Choi, Hong Dae
Seo, Pil Ja
Lee, Uk
author_sort Choi, Hong Dae
collection PubMed
description In the title compound, C(21)H(21)FO(2)S, the cyclo­hexyl ring adopts a chair conformation. The 2-fluoro­benzene ring makes a dihedral angle of 38.68 (6)° with the mean plane [r.m.s. deviation = 0.018 (2) Å] of the benzo­furan fragment. In the crystal, mol­ecules are linked by pairs of C—H⋯O hydrogen bonds into dimers, which are further packed into stacks along the c axis by C—H⋯O hydrogen bonds. In addition, the stacked mol­ecules exhibit S⋯O contacts [3.1733 (13) Å] involving the sulfinyl groups. The F atom is disordered over two positions, with site-occupancy factors of 0.961 (3) and 0.039 (3).
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spelling pubmed-36850442013-06-21 5-Cyclo­hexyl-2-(2-fluoro­phen­yl)-3-methyl­sulfinyl-1-benzo­furan Choi, Hong Dae Seo, Pil Ja Lee, Uk Acta Crystallogr Sect E Struct Rep Online Organic Papers In the title compound, C(21)H(21)FO(2)S, the cyclo­hexyl ring adopts a chair conformation. The 2-fluoro­benzene ring makes a dihedral angle of 38.68 (6)° with the mean plane [r.m.s. deviation = 0.018 (2) Å] of the benzo­furan fragment. In the crystal, mol­ecules are linked by pairs of C—H⋯O hydrogen bonds into dimers, which are further packed into stacks along the c axis by C—H⋯O hydrogen bonds. In addition, the stacked mol­ecules exhibit S⋯O contacts [3.1733 (13) Å] involving the sulfinyl groups. The F atom is disordered over two positions, with site-occupancy factors of 0.961 (3) and 0.039 (3). International Union of Crystallography 2013-05-15 /pmc/articles/PMC3685044/ /pubmed/23795063 http://dx.doi.org/10.1107/S1600536813012701 Text en © Choi et al. 2013 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
Choi, Hong Dae
Seo, Pil Ja
Lee, Uk
5-Cyclo­hexyl-2-(2-fluoro­phen­yl)-3-methyl­sulfinyl-1-benzo­furan
title 5-Cyclo­hexyl-2-(2-fluoro­phen­yl)-3-methyl­sulfinyl-1-benzo­furan
title_full 5-Cyclo­hexyl-2-(2-fluoro­phen­yl)-3-methyl­sulfinyl-1-benzo­furan
title_fullStr 5-Cyclo­hexyl-2-(2-fluoro­phen­yl)-3-methyl­sulfinyl-1-benzo­furan
title_full_unstemmed 5-Cyclo­hexyl-2-(2-fluoro­phen­yl)-3-methyl­sulfinyl-1-benzo­furan
title_short 5-Cyclo­hexyl-2-(2-fluoro­phen­yl)-3-methyl­sulfinyl-1-benzo­furan
title_sort 5-cyclo­hexyl-2-(2-fluoro­phen­yl)-3-methyl­sulfinyl-1-benzo­furan
topic Organic Papers
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3685044/
https://www.ncbi.nlm.nih.gov/pubmed/23795063
http://dx.doi.org/10.1107/S1600536813012701
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AT leeuk 5cyclohexyl22fluorophenyl3methylsulfinyl1benzofuran

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