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Crystal structure of 2-(4-tert-butylphenyl)-3-hydroxy-4H-chromen-4-one
Yellow–green fluorescent crystals of the title compound, C(19)H(18)O(3), were obtained by the reaction of hydroxyacetophenone and 4-tert-butylbenzaldehyde with hydrogen peroxide as oxidant. The plane of the benzene ring is slightly twisted to the mean plane of the 4H-chromene-4-one moiety (r.m.s...
Autores principales: | , , |
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Formato: | Online Artículo Texto |
Lenguaje: | English |
Publicado: |
International Union of Crystallography
2015
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Materias: | |
Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4518945/ https://www.ncbi.nlm.nih.gov/pubmed/26279877 http://dx.doi.org/10.1107/S2056989015011482 |
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author | Narita, Fuka Takura, Akihiro Fujihara, Takashi |
author_facet | Narita, Fuka Takura, Akihiro Fujihara, Takashi |
author_sort | Narita, Fuka |
collection | PubMed |
description | Yellow–green fluorescent crystals of the title compound, C(19)H(18)O(3), were obtained by the reaction of hydroxyacetophenone and 4-tert-butylbenzaldehyde with hydrogen peroxide as oxidant. The plane of the benzene ring is slightly twisted to the mean plane of the 4H-chromene-4-one moiety (r.m.s. deviation = 0.0191 Å) by 10.53 (8)°. In the crystal, molecules are linked by pairs of O—H⋯O hydrogen bonds, forming inversion dimers with an R (2) (2)(10) ring motif. The dimers are linked via C—H⋯π interactions, forming sheets parallel to (10-1). |
format | Online Article Text |
id | pubmed-4518945 |
institution | National Center for Biotechnology Information |
language | English |
publishDate | 2015 |
publisher | International Union of Crystallography |
record_format | MEDLINE/PubMed |
spelling | pubmed-45189452015-08-14 Crystal structure of 2-(4-tert-butylphenyl)-3-hydroxy-4H-chromen-4-one Narita, Fuka Takura, Akihiro Fujihara, Takashi Acta Crystallogr E Crystallogr Commun Research Communications Yellow–green fluorescent crystals of the title compound, C(19)H(18)O(3), were obtained by the reaction of hydroxyacetophenone and 4-tert-butylbenzaldehyde with hydrogen peroxide as oxidant. The plane of the benzene ring is slightly twisted to the mean plane of the 4H-chromene-4-one moiety (r.m.s. deviation = 0.0191 Å) by 10.53 (8)°. In the crystal, molecules are linked by pairs of O—H⋯O hydrogen bonds, forming inversion dimers with an R (2) (2)(10) ring motif. The dimers are linked via C—H⋯π interactions, forming sheets parallel to (10-1). International Union of Crystallography 2015-06-24 /pmc/articles/PMC4518945/ /pubmed/26279877 http://dx.doi.org/10.1107/S2056989015011482 Text en © Narita et al. 2015 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 | Research Communications Narita, Fuka Takura, Akihiro Fujihara, Takashi Crystal structure of 2-(4-tert-butylphenyl)-3-hydroxy-4H-chromen-4-one |
title | Crystal structure of 2-(4-tert-butylphenyl)-3-hydroxy-4H-chromen-4-one |
title_full | Crystal structure of 2-(4-tert-butylphenyl)-3-hydroxy-4H-chromen-4-one |
title_fullStr | Crystal structure of 2-(4-tert-butylphenyl)-3-hydroxy-4H-chromen-4-one |
title_full_unstemmed | Crystal structure of 2-(4-tert-butylphenyl)-3-hydroxy-4H-chromen-4-one |
title_short | Crystal structure of 2-(4-tert-butylphenyl)-3-hydroxy-4H-chromen-4-one |
title_sort | crystal structure of 2-(4-tert-butylphenyl)-3-hydroxy-4h-chromen-4-one |
topic | Research Communications |
url | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4518945/ https://www.ncbi.nlm.nih.gov/pubmed/26279877 http://dx.doi.org/10.1107/S2056989015011482 |
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