5-Bromo-2-methyl-3-(4-methyl­phenyl­sulfon­yl)-1-benzofuran

In the title compound, C(16)H(13)BrO(3)S, the 4-methyl­phenyl group makes a dihedral angle of 70.1 (1)° with the mean plane [average deviation = 0.012 (2) Å] of the benzofuran unit. In the crystal, mol­ecules are linked by weak C—H⋯O hydrogen bonds. There are also π–π inter­actions between the furan...

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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 2012
Materias:
Organic Papers
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3393953/
https://www.ncbi.nlm.nih.gov/pubmed/22798818
http://dx.doi.org/10.1107/S1600536812026918
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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(16)H(13)BrO(3)S, the 4-methyl­phenyl group makes a dihedral angle of 70.1 (1)° with the mean plane [average deviation = 0.012 (2) Å] of the benzofuran unit. In the crystal, mol­ecules are linked by weak C—H⋯O hydrogen bonds. There are also π–π inter­actions between the furan and benzene rings of adjacent benzofuran systems [centroid–centroid distances = 3.621 (2) and 3.665 (2) Å], along with halogen–halogen inter­actions [Br⋯Br separation = 3.674 (1) Å].
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spelling pubmed-33939532012-07-13 5-Bromo-2-methyl-3-(4-methyl­phenyl­sulfon­yl)-1-benzofuran Choi, Hong Dae Seo, Pil Ja Lee, Uk Acta Crystallogr Sect E Struct Rep Online Organic Papers In the title compound, C(16)H(13)BrO(3)S, the 4-methyl­phenyl group makes a dihedral angle of 70.1 (1)° with the mean plane [average deviation = 0.012 (2) Å] of the benzofuran unit. In the crystal, mol­ecules are linked by weak C—H⋯O hydrogen bonds. There are also π–π inter­actions between the furan and benzene rings of adjacent benzofuran systems [centroid–centroid distances = 3.621 (2) and 3.665 (2) Å], along with halogen–halogen inter­actions [Br⋯Br separation = 3.674 (1) Å]. International Union of Crystallography 2012-06-20 /pmc/articles/PMC3393953/ /pubmed/22798818 http://dx.doi.org/10.1107/S1600536812026918 Text en © Choi et al. 2012 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-Bromo-2-methyl-3-(4-methyl­phenyl­sulfon­yl)-1-benzofuran
title 5-Bromo-2-methyl-3-(4-methyl­phenyl­sulfon­yl)-1-benzofuran
title_full 5-Bromo-2-methyl-3-(4-methyl­phenyl­sulfon­yl)-1-benzofuran
title_fullStr 5-Bromo-2-methyl-3-(4-methyl­phenyl­sulfon­yl)-1-benzofuran
title_full_unstemmed 5-Bromo-2-methyl-3-(4-methyl­phenyl­sulfon­yl)-1-benzofuran
title_short 5-Bromo-2-methyl-3-(4-methyl­phenyl­sulfon­yl)-1-benzofuran
title_sort 5-bromo-2-methyl-3-(4-methyl­phenyl­sulfon­yl)-1-benzofuran
topic Organic Papers
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3393953/
https://www.ncbi.nlm.nih.gov/pubmed/22798818
http://dx.doi.org/10.1107/S1600536812026918
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