1-(3-Phenyl­isoxazol-5-yl)cyclo­hexane-1,2-diol

In the title compound, C(15)H(17)NO(3), there are two mol­ecules in the asymmetric unit wherein the isoxazole rings make dihedral angles of 16.16 (15) and 16.79 (13)° with the benzene rings, and the cyclo­hexane rings adopt chair conformations. In both mol­ecules, the hydroxyl groups of the diol fra...

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Autores principales: Astudillo, Luis, Brito, Iván, Vallejos, Gabriel, Gutíerrez, Margarita, López-Rodríguez, Matías
Formato: Texto
Lenguaje:English
Publicado: International Union of Crystallography 2009
Materias:
Organic Papers
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC2969214/
https://www.ncbi.nlm.nih.gov/pubmed/21582805
http://dx.doi.org/10.1107/S1600536809020947
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author Astudillo, Luis
Brito, Iván
Vallejos, Gabriel
Gutíerrez, Margarita
López-Rodríguez, Matías
author_facet Astudillo, Luis
Brito, Iván
Vallejos, Gabriel
Gutíerrez, Margarita
López-Rodríguez, Matías
author_sort Astudillo, Luis
collection PubMed
description In the title compound, C(15)H(17)NO(3), there are two mol­ecules in the asymmetric unit wherein the isoxazole rings make dihedral angles of 16.16 (15) and 16.79 (13)° with the benzene rings, and the cyclo­hexane rings adopt chair conformations. In both mol­ecules, the hydroxyl groups of the diol fragments are cis oriented, the O—C—C—O torsion angles being 60.76 (12) and −55.86 (11)°. The two mol­ecules are linked by a strong O—H⋯N hydrogen bond and the crystal packing is stabilized by one O—H⋯N and two O—H⋯O hydrogen bonds. An intra­molecular O—H⋯O hydrogen bond is observed in one of the mol­ecules.
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spelling pubmed-29692142010-12-30 1-(3-Phenyl­isoxazol-5-yl)cyclo­hexane-1,2-diol Astudillo, Luis Brito, Iván Vallejos, Gabriel Gutíerrez, Margarita López-Rodríguez, Matías Acta Crystallogr Sect E Struct Rep Online Organic Papers In the title compound, C(15)H(17)NO(3), there are two mol­ecules in the asymmetric unit wherein the isoxazole rings make dihedral angles of 16.16 (15) and 16.79 (13)° with the benzene rings, and the cyclo­hexane rings adopt chair conformations. In both mol­ecules, the hydroxyl groups of the diol fragments are cis oriented, the O—C—C—O torsion angles being 60.76 (12) and −55.86 (11)°. The two mol­ecules are linked by a strong O—H⋯N hydrogen bond and the crystal packing is stabilized by one O—H⋯N and two O—H⋯O hydrogen bonds. An intra­molecular O—H⋯O hydrogen bond is observed in one of the mol­ecules. International Union of Crystallography 2009-06-06 /pmc/articles/PMC2969214/ /pubmed/21582805 http://dx.doi.org/10.1107/S1600536809020947 Text en © Astudillo 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
Astudillo, Luis
Brito, Iván
Vallejos, Gabriel
Gutíerrez, Margarita
López-Rodríguez, Matías
1-(3-Phenyl­isoxazol-5-yl)cyclo­hexane-1,2-diol
title 1-(3-Phenyl­isoxazol-5-yl)cyclo­hexane-1,2-diol
title_full 1-(3-Phenyl­isoxazol-5-yl)cyclo­hexane-1,2-diol
title_fullStr 1-(3-Phenyl­isoxazol-5-yl)cyclo­hexane-1,2-diol
title_full_unstemmed 1-(3-Phenyl­isoxazol-5-yl)cyclo­hexane-1,2-diol
title_short 1-(3-Phenyl­isoxazol-5-yl)cyclo­hexane-1,2-diol
title_sort 1-(3-phenyl­isoxazol-5-yl)cyclo­hexane-1,2-diol
topic Organic Papers
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC2969214/
https://www.ncbi.nlm.nih.gov/pubmed/21582805
http://dx.doi.org/10.1107/S1600536809020947
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