Cargando…

Methyl 2-[5-(4-hydroxy­phen­yl)-3-methyl­sulfanyl-1-benzofuran-2-yl]acetate

In the title compound, C(18)H(16)O(4)S, the 4-hydroxy­phenyl ring is rotated out of the benzofuran plane, making a dihedral angle of 34.52 (6)°. The methyl group of the methyl­sulfanyl substituent is almost perpendicular to the plane of the benzofuran fragment [100.90 (8)°] and is slightly tilted to...

Descripción completa

Detalles Bibliográficos
Autores principales: Choi, Hong Dae, Seo, Pil Ja, Son, Byeng Wha, Lee, Uk
Formato: Texto
Lenguaje:English
Publicado: International Union of Crystallography 2009
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC2970204/
https://www.ncbi.nlm.nih.gov/pubmed/21577974
http://dx.doi.org/10.1107/S1600536809037763
_version_ 1782190377548120064
author Choi, Hong Dae
Seo, Pil Ja
Son, Byeng Wha
Lee, Uk
author_facet Choi, Hong Dae
Seo, Pil Ja
Son, Byeng Wha
Lee, Uk
author_sort Choi, Hong Dae
collection PubMed
description In the title compound, C(18)H(16)O(4)S, the 4-hydroxy­phenyl ring is rotated out of the benzofuran plane, making a dihedral angle of 34.52 (6)°. The methyl group of the methyl­sulfanyl substituent is almost perpendicular to the plane of the benzofuran fragment [100.90 (8)°] and is slightly tilted towards it. The crystal structure is stabilized by inter­molecular O—H⋯O hydrogen bonds, and by inter­molecular C—H⋯π inter­actions between a methyl H atom of the methyl­sulfanyl substituent and the 4-hydroxy­phenyl ring.
format Text
id pubmed-2970204
institution National Center for Biotechnology Information
language English
publishDate 2009
publisher International Union of Crystallography
record_format MEDLINE/PubMed
spelling pubmed-29702042010-12-30 Methyl 2-[5-(4-hydroxy­phen­yl)-3-methyl­sulfanyl-1-benzofuran-2-yl]acetate Choi, Hong Dae Seo, Pil Ja Son, Byeng Wha Lee, Uk Acta Crystallogr Sect E Struct Rep Online Organic Papers In the title compound, C(18)H(16)O(4)S, the 4-hydroxy­phenyl ring is rotated out of the benzofuran plane, making a dihedral angle of 34.52 (6)°. The methyl group of the methyl­sulfanyl substituent is almost perpendicular to the plane of the benzofuran fragment [100.90 (8)°] and is slightly tilted towards it. The crystal structure is stabilized by inter­molecular O—H⋯O hydrogen bonds, and by inter­molecular C—H⋯π inter­actions between a methyl H atom of the methyl­sulfanyl substituent and the 4-hydroxy­phenyl ring. International Union of Crystallography 2009-09-26 /pmc/articles/PMC2970204/ /pubmed/21577974 http://dx.doi.org/10.1107/S1600536809037763 Text en © Choi et al. 2009 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
Son, Byeng Wha
Lee, Uk
Methyl 2-[5-(4-hydroxy­phen­yl)-3-methyl­sulfanyl-1-benzofuran-2-yl]acetate
title Methyl 2-[5-(4-hydroxy­phen­yl)-3-methyl­sulfanyl-1-benzofuran-2-yl]acetate
title_full Methyl 2-[5-(4-hydroxy­phen­yl)-3-methyl­sulfanyl-1-benzofuran-2-yl]acetate
title_fullStr Methyl 2-[5-(4-hydroxy­phen­yl)-3-methyl­sulfanyl-1-benzofuran-2-yl]acetate
title_full_unstemmed Methyl 2-[5-(4-hydroxy­phen­yl)-3-methyl­sulfanyl-1-benzofuran-2-yl]acetate
title_short Methyl 2-[5-(4-hydroxy­phen­yl)-3-methyl­sulfanyl-1-benzofuran-2-yl]acetate
title_sort methyl 2-[5-(4-hydroxy­phen­yl)-3-methyl­sulfanyl-1-benzofuran-2-yl]acetate
topic Organic Papers
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC2970204/
https://www.ncbi.nlm.nih.gov/pubmed/21577974
http://dx.doi.org/10.1107/S1600536809037763
work_keys_str_mv AT choihongdae methyl254hydroxyphenyl3methylsulfanyl1benzofuran2ylacetate
AT seopilja methyl254hydroxyphenyl3methylsulfanyl1benzofuran2ylacetate
AT sonbyengwha methyl254hydroxyphenyl3methylsulfanyl1benzofuran2ylacetate
AT leeuk methyl254hydroxyphenyl3methylsulfanyl1benzofuran2ylacetate