1-(2-Fluoro­phen­yl)-6,7-dimethoxy­isochroman

In the title compound, C(17)H(17)FO(3), the benzene ring of the isochroman unit is inclined at 84.96 (7)° to the fluoro­benzene ring plane, and the pyran ring adopts a half-boat conformation. In the crystal structure, C—H⋯O hydrogen bonds link mol­ecules into rows along the c axis, while C—H⋯O inter...

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Detalles Bibliográficos
Autores principales: Saeed, Aamer, Simpson, Jim, Stanley, Roderick G.
Formato: Texto
Lenguaje:English
Publicado: International Union of Crystallography 2009
Materias:
Organic Papers
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC2969092/
https://www.ncbi.nlm.nih.gov/pubmed/21582580
http://dx.doi.org/10.1107/S160053680900926X
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author Saeed, Aamer
Simpson, Jim
Stanley, Roderick G.
author_facet Saeed, Aamer
Simpson, Jim
Stanley, Roderick G.
author_sort Saeed, Aamer
collection PubMed
description In the title compound, C(17)H(17)FO(3), the benzene ring of the isochroman unit is inclined at 84.96 (7)° to the fluoro­benzene ring plane, and the pyran ring adopts a half-boat conformation. In the crystal structure, C—H⋯O hydrogen bonds link mol­ecules into rows along the c axis, while C—H⋯O inter­actions and C—H⋯F hydrogen bonds to the fluorine acceptor stack the mol­ecules down the b axis. In addition, the crystal structure exhibits a weak C—H⋯π inter­action between a methyl H atom of the meth­oxy group and the dimethoxy­benzene ring of an adjacent mol­ecule.
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spelling pubmed-29690922010-12-30 1-(2-Fluoro­phen­yl)-6,7-dimethoxy­isochroman Saeed, Aamer Simpson, Jim Stanley, Roderick G. Acta Crystallogr Sect E Struct Rep Online Organic Papers In the title compound, C(17)H(17)FO(3), the benzene ring of the isochroman unit is inclined at 84.96 (7)° to the fluoro­benzene ring plane, and the pyran ring adopts a half-boat conformation. In the crystal structure, C—H⋯O hydrogen bonds link mol­ecules into rows along the c axis, while C—H⋯O inter­actions and C—H⋯F hydrogen bonds to the fluorine acceptor stack the mol­ecules down the b axis. In addition, the crystal structure exhibits a weak C—H⋯π inter­action between a methyl H atom of the meth­oxy group and the dimethoxy­benzene ring of an adjacent mol­ecule. International Union of Crystallography 2009-03-25 /pmc/articles/PMC2969092/ /pubmed/21582580 http://dx.doi.org/10.1107/S160053680900926X Text en © Saeed 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
Saeed, Aamer
Simpson, Jim
Stanley, Roderick G.
1-(2-Fluoro­phen­yl)-6,7-dimethoxy­isochroman
title 1-(2-Fluoro­phen­yl)-6,7-dimethoxy­isochroman
title_full 1-(2-Fluoro­phen­yl)-6,7-dimethoxy­isochroman
title_fullStr 1-(2-Fluoro­phen­yl)-6,7-dimethoxy­isochroman
title_full_unstemmed 1-(2-Fluoro­phen­yl)-6,7-dimethoxy­isochroman
title_short 1-(2-Fluoro­phen­yl)-6,7-dimethoxy­isochroman
title_sort 1-(2-fluoro­phen­yl)-6,7-dimethoxy­isochroman
topic Organic Papers
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC2969092/
https://www.ncbi.nlm.nih.gov/pubmed/21582580
http://dx.doi.org/10.1107/S160053680900926X
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AT simpsonjim 12fluorophenyl67dimethoxyisochroman
AT stanleyroderickg 12fluorophenyl67dimethoxyisochroman

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