2,3,5-Trimethyl-1,4-hydro­quinone

The mol­ecule of the title compound, C(9)H(12)O(2), is approximately planar (mean atomic deviation = 0.0346 Å) and disposed about a crystallographic centre of symmetry. The H atom of the benzene ring is disordered over four orientations, with occupancies of 0.100 (3) and 0.401 (3) at the C atoms in...

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Detalles Bibliográficos
Autores principales: Dai, Jun, Xie, Min-Hao, Liu, Ya-Ling, Zou, Pei, Wu, Hao
Formato: Texto
Lenguaje:English
Publicado: International Union of Crystallography 2010
Materias:
Organic Papers
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC2979790/
https://www.ncbi.nlm.nih.gov/pubmed/21579736
http://dx.doi.org/10.1107/S1600536810000140
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author Dai, Jun
Xie, Min-Hao
Liu, Ya-Ling
Zou, Pei
Wu, Hao
author_facet Dai, Jun
Xie, Min-Hao
Liu, Ya-Ling
Zou, Pei
Wu, Hao
author_sort Dai, Jun
collection PubMed
description The mol­ecule of the title compound, C(9)H(12)O(2), is approximately planar (mean atomic deviation = 0.0346 Å) and disposed about a crystallographic centre of symmetry. The H atom of the benzene ring is disordered over four orientations, with occupancies of 0.100 (3) and 0.401 (3) at the C atoms in the 2- and 3-positions and the same at their symmetric location. The H atoms of methyl group at the 2-position are disordered over two positions of equal occupancy. In the crystal structure, adjacent mol­ecules are linked through O—H⋯O hydrogen bonds, forming a two-dimensional network.
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spelling pubmed-29797902010-12-30 2,3,5-Trimethyl-1,4-hydro­quinone Dai, Jun Xie, Min-Hao Liu, Ya-Ling Zou, Pei Wu, Hao Acta Crystallogr Sect E Struct Rep Online Organic Papers The mol­ecule of the title compound, C(9)H(12)O(2), is approximately planar (mean atomic deviation = 0.0346 Å) and disposed about a crystallographic centre of symmetry. The H atom of the benzene ring is disordered over four orientations, with occupancies of 0.100 (3) and 0.401 (3) at the C atoms in the 2- and 3-positions and the same at their symmetric location. The H atoms of methyl group at the 2-position are disordered over two positions of equal occupancy. In the crystal structure, adjacent mol­ecules are linked through O—H⋯O hydrogen bonds, forming a two-dimensional network. International Union of Crystallography 2010-01-09 /pmc/articles/PMC2979790/ /pubmed/21579736 http://dx.doi.org/10.1107/S1600536810000140 Text en © Dai et al. 2010 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
Dai, Jun
Xie, Min-Hao
Liu, Ya-Ling
Zou, Pei
Wu, Hao
2,3,5-Trimethyl-1,4-hydro­quinone
title 2,3,5-Trimethyl-1,4-hydro­quinone
title_full 2,3,5-Trimethyl-1,4-hydro­quinone
title_fullStr 2,3,5-Trimethyl-1,4-hydro­quinone
title_full_unstemmed 2,3,5-Trimethyl-1,4-hydro­quinone
title_short 2,3,5-Trimethyl-1,4-hydro­quinone
title_sort 2,3,5-trimethyl-1,4-hydro­quinone
topic Organic Papers
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC2979790/
https://www.ncbi.nlm.nih.gov/pubmed/21579736
http://dx.doi.org/10.1107/S1600536810000140
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