1-(1,3-Benzodioxol-5-yl)pentan-1-one

In the mol­ecule of title compound, C(12)H(14)O(3), the benzodioxole ring system is essentially planar. In the crystal structure, weak inter­molecular C—H⋯O hydrogen bonds link mol­ecules into chains along the c axis, and π–π contacts between dioxole rings and between dioxole and benzene rings of th...

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Detalles Bibliográficos
Autores principales: Wang, Xiao-Ming, Cheng, Wei, Han, Yu-Wang
Formato: Texto
Lenguaje:English
Publicado: International Union of Crystallography 2008
Materias:
Organic Papers
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC2968086/
https://www.ncbi.nlm.nih.gov/pubmed/21581632
http://dx.doi.org/10.1107/S1600536808040257
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author Wang, Xiao-Ming
Cheng, Wei
Han, Yu-Wang
author_facet Wang, Xiao-Ming
Cheng, Wei
Han, Yu-Wang
author_sort Wang, Xiao-Ming
collection PubMed
description In the mol­ecule of title compound, C(12)H(14)O(3), the benzodioxole ring system is essentially planar. In the crystal structure, weak inter­molecular C—H⋯O hydrogen bonds link mol­ecules into chains along the c axis, and π–π contacts between dioxole rings and between dioxole and benzene rings of the benzodioxole ring systems [centroid–centroid distances 3.702 (3) and 3.903 (3) Å] may further stabilize the structure. Two C—H⋯π inter­actions are also found.
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spelling pubmed-29680862010-12-30 1-(1,3-Benzodioxol-5-yl)pentan-1-one Wang, Xiao-Ming Cheng, Wei Han, Yu-Wang Acta Crystallogr Sect E Struct Rep Online Organic Papers In the mol­ecule of title compound, C(12)H(14)O(3), the benzodioxole ring system is essentially planar. In the crystal structure, weak inter­molecular C—H⋯O hydrogen bonds link mol­ecules into chains along the c axis, and π–π contacts between dioxole rings and between dioxole and benzene rings of the benzodioxole ring systems [centroid–centroid distances 3.702 (3) and 3.903 (3) Å] may further stabilize the structure. Two C—H⋯π inter­actions are also found. International Union of Crystallography 2008-12-20 /pmc/articles/PMC2968086/ /pubmed/21581632 http://dx.doi.org/10.1107/S1600536808040257 Text en © Wang 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
Wang, Xiao-Ming
Cheng, Wei
Han, Yu-Wang
1-(1,3-Benzodioxol-5-yl)pentan-1-one
title 1-(1,3-Benzodioxol-5-yl)pentan-1-one
title_full 1-(1,3-Benzodioxol-5-yl)pentan-1-one
title_fullStr 1-(1,3-Benzodioxol-5-yl)pentan-1-one
title_full_unstemmed 1-(1,3-Benzodioxol-5-yl)pentan-1-one
title_short 1-(1,3-Benzodioxol-5-yl)pentan-1-one
title_sort 1-(1,3-benzodioxol-5-yl)pentan-1-one
topic Organic Papers
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC2968086/
https://www.ncbi.nlm.nih.gov/pubmed/21581632
http://dx.doi.org/10.1107/S1600536808040257
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