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Butyl 2-(5-bromo-3-methyl­sulfinyl-1-benzofuran-2-yl)acetate

In the title compound, C(15)H(17)BrO(4)S, the methyl­sulfinyl O atom and the methyl substituents lie on opposite sides of the plane through the benzofuran fragment. The crystal structure is stabilized by π–π inter­actions between the benzene rings of neighbouring mol­ecules [centroid–centroid distan...

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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/PMC2968244/
https://www.ncbi.nlm.nih.gov/pubmed/21581880
http://dx.doi.org/10.1107/S1600536808043985
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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(15)H(17)BrO(4)S, the methyl­sulfinyl O atom and the methyl substituents lie on opposite sides of the plane through the benzofuran fragment. The crystal structure is stabilized by π–π inter­actions between the benzene rings of neighbouring mol­ecules [centroid–centroid distance = 3.698 (4) Å], and by C—H⋯π inter­actions between a methyl­ene H atom of the butyl group and the benzene ring of the benzofuran system. Additionally, the crystal structure exhibits weak inter­molecular C—H⋯O contacts. The butyl group is disordered over two positions, with site-occupancy factors, from refinement, of 0.720 (8) and 0.280 (8).
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spelling pubmed-29682442010-12-30 Butyl 2-(5-bromo-3-methyl­sulfinyl-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(15)H(17)BrO(4)S, the methyl­sulfinyl O atom and the methyl substituents lie on opposite sides of the plane through the benzofuran fragment. The crystal structure is stabilized by π–π inter­actions between the benzene rings of neighbouring mol­ecules [centroid–centroid distance = 3.698 (4) Å], and by C—H⋯π inter­actions between a methyl­ene H atom of the butyl group and the benzene ring of the benzofuran system. Additionally, the crystal structure exhibits weak inter­molecular C—H⋯O contacts. The butyl group is disordered over two positions, with site-occupancy factors, from refinement, of 0.720 (8) and 0.280 (8). International Union of Crystallography 2009-01-08 /pmc/articles/PMC2968244/ /pubmed/21581880 http://dx.doi.org/10.1107/S1600536808043985 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
Butyl 2-(5-bromo-3-methyl­sulfinyl-1-benzofuran-2-yl)acetate
title Butyl 2-(5-bromo-3-methyl­sulfinyl-1-benzofuran-2-yl)acetate
title_full Butyl 2-(5-bromo-3-methyl­sulfinyl-1-benzofuran-2-yl)acetate
title_fullStr Butyl 2-(5-bromo-3-methyl­sulfinyl-1-benzofuran-2-yl)acetate
title_full_unstemmed Butyl 2-(5-bromo-3-methyl­sulfinyl-1-benzofuran-2-yl)acetate
title_short Butyl 2-(5-bromo-3-methyl­sulfinyl-1-benzofuran-2-yl)acetate
title_sort butyl 2-(5-bromo-3-methyl­sulfinyl-1-benzofuran-2-yl)acetate
topic Organic Papers
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC2968244/
https://www.ncbi.nlm.nih.gov/pubmed/21581880
http://dx.doi.org/10.1107/S1600536808043985
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