8-Acetyl-4-methyl-2-oxo-2H-chromen-7-yl acetate

In the title compound, C(14)H(12)O(5), the benzopyran-2-one ring system is approximately planar [maximum deviation = 0.018 (1) Å]; the mean plane is oriented at dihedral angles of 52.26 (11) and 72.92 (7)°, respectively, to the acetyl and acet­oxy groups. In the crystal, π–π stacking is observed bet...

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Autores principales: Yang, Shu-Ping, Han, Li-Jun, He, Xin-Ran, Chen, Li-Juan
Formato: Online Artículo Texto
Lenguaje:English
Publicado: International Union of Crystallography 2011
Materias:
Organic Papers
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3239025/
https://www.ncbi.nlm.nih.gov/pubmed/22199873
http://dx.doi.org/10.1107/S1600536811048835
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author Yang, Shu-Ping
Han, Li-Jun
He, Xin-Ran
Chen, Li-Juan
author_facet Yang, Shu-Ping
Han, Li-Jun
He, Xin-Ran
Chen, Li-Juan
author_sort Yang, Shu-Ping
collection PubMed
description In the title compound, C(14)H(12)O(5), the benzopyran-2-one ring system is approximately planar [maximum deviation = 0.018 (1) Å]; the mean plane is oriented at dihedral angles of 52.26 (11) and 72.92 (7)°, respectively, to the acetyl and acet­oxy groups. In the crystal, π–π stacking is observed between parallel benzene rings of adjacent mol­ecules, the centroid–centroid distance being 3.6774 (17) Å. Inter­molecular weak C—H⋯O hydrogen bonding, and C=O⋯C=O [O⋯C = 3.058 (3) Å] and C=O⋯π [O⋯centroid = 3.328 (2) Å] inter­actions occur in the crystal structure.
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spelling pubmed-32390252011-12-23 8-Acetyl-4-methyl-2-oxo-2H-chromen-7-yl acetate Yang, Shu-Ping Han, Li-Jun He, Xin-Ran Chen, Li-Juan Acta Crystallogr Sect E Struct Rep Online Organic Papers In the title compound, C(14)H(12)O(5), the benzopyran-2-one ring system is approximately planar [maximum deviation = 0.018 (1) Å]; the mean plane is oriented at dihedral angles of 52.26 (11) and 72.92 (7)°, respectively, to the acetyl and acet­oxy groups. In the crystal, π–π stacking is observed between parallel benzene rings of adjacent mol­ecules, the centroid–centroid distance being 3.6774 (17) Å. Inter­molecular weak C—H⋯O hydrogen bonding, and C=O⋯C=O [O⋯C = 3.058 (3) Å] and C=O⋯π [O⋯centroid = 3.328 (2) Å] inter­actions occur in the crystal structure. International Union of Crystallography 2011-11-19 /pmc/articles/PMC3239025/ /pubmed/22199873 http://dx.doi.org/10.1107/S1600536811048835 Text en © Yang et al. 2011 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
Yang, Shu-Ping
Han, Li-Jun
He, Xin-Ran
Chen, Li-Juan
8-Acetyl-4-methyl-2-oxo-2H-chromen-7-yl acetate
title 8-Acetyl-4-methyl-2-oxo-2H-chromen-7-yl acetate
title_full 8-Acetyl-4-methyl-2-oxo-2H-chromen-7-yl acetate
title_fullStr 8-Acetyl-4-methyl-2-oxo-2H-chromen-7-yl acetate
title_full_unstemmed 8-Acetyl-4-methyl-2-oxo-2H-chromen-7-yl acetate
title_short 8-Acetyl-4-methyl-2-oxo-2H-chromen-7-yl acetate
title_sort 8-acetyl-4-methyl-2-oxo-2h-chromen-7-yl acetate
topic Organic Papers
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3239025/
https://www.ncbi.nlm.nih.gov/pubmed/22199873
http://dx.doi.org/10.1107/S1600536811048835
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AT hanlijun 8acetyl4methyl2oxo2hchromen7ylacetate
AT hexinran 8acetyl4methyl2oxo2hchromen7ylacetate
AT chenlijuan 8acetyl4methyl2oxo2hchromen7ylacetate

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