Isopropyl 2-(5-fluoro-3-methyl­sulfinyl-1-benzofuran-2-yl)acetate

In the title compound, C(14)H(15)FO(4)S, the O atom and the methyl group of the methyl­sulfinyl substituent are located on opposite sides of the plane of the benzofuran fragment which is essentially planar with a mean deviation of 0.008 (1) Å from its least-squares plane. The crystal structure stabi...

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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:
Organic Papers
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC2970216/
https://www.ncbi.nlm.nih.gov/pubmed/21577938
http://dx.doi.org/10.1107/S1600536809037003
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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(14)H(15)FO(4)S, the O atom and the methyl group of the methyl­sulfinyl substituent are located on opposite sides of the plane of the benzofuran fragment which is essentially planar with a mean deviation of 0.008 (1) Å from its least-squares plane. The crystal structure stabilized by three different inter­molecular non-classical C—H⋯O hydrogen bonds. The crystal structure also exhibits aromatic π–π inter­actions between the benzene rings of adjacent benzofuran ring systems [centroid–centroid distance = 3.688 (2) Å]
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spelling pubmed-29702162010-12-30 Isopropyl 2-(5-fluoro-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(14)H(15)FO(4)S, the O atom and the methyl group of the methyl­sulfinyl substituent are located on opposite sides of the plane of the benzofuran fragment which is essentially planar with a mean deviation of 0.008 (1) Å from its least-squares plane. The crystal structure stabilized by three different inter­molecular non-classical C—H⋯O hydrogen bonds. The crystal structure also exhibits aromatic π–π inter­actions between the benzene rings of adjacent benzofuran ring systems [centroid–centroid distance = 3.688 (2) Å] International Union of Crystallography 2009-09-19 /pmc/articles/PMC2970216/ /pubmed/21577938 http://dx.doi.org/10.1107/S1600536809037003 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
Isopropyl 2-(5-fluoro-3-methyl­sulfinyl-1-benzofuran-2-yl)acetate
title Isopropyl 2-(5-fluoro-3-methyl­sulfinyl-1-benzofuran-2-yl)acetate
title_full Isopropyl 2-(5-fluoro-3-methyl­sulfinyl-1-benzofuran-2-yl)acetate
title_fullStr Isopropyl 2-(5-fluoro-3-methyl­sulfinyl-1-benzofuran-2-yl)acetate
title_full_unstemmed Isopropyl 2-(5-fluoro-3-methyl­sulfinyl-1-benzofuran-2-yl)acetate
title_short Isopropyl 2-(5-fluoro-3-methyl­sulfinyl-1-benzofuran-2-yl)acetate
title_sort isopropyl 2-(5-fluoro-3-methyl­sulfinyl-1-benzofuran-2-yl)acetate
topic Organic Papers
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC2970216/
https://www.ncbi.nlm.nih.gov/pubmed/21577938
http://dx.doi.org/10.1107/S1600536809037003
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AT seopilja isopropyl25fluoro3methylsulfinyl1benzofuran2ylacetate
AT sonbyengwha isopropyl25fluoro3methylsulfinyl1benzofuran2ylacetate
AT leeuk isopropyl25fluoro3methylsulfinyl1benzofuran2ylacetate

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