Methyl gallate

The crystal structure of the title compound (systematic name: methyl 3,4,5-trihydroxy­benzoate), C(8)H(8)O(5), is composed of essentially planar mol­ecules [maximum departures from the mean carbon and oxygen skeleton plane of 0.0348 (10) Å]. The H atoms of the three hydroxyl groups, which function a...

Descripción completa

Detalles Bibliográficos
Autores principales: Bebout, Deborah, Pagola, Silvina
Formato: Texto
Lenguaje:English
Publicado: International Union of Crystallography 2009
Materias:
Organic Papers
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC2968310/
https://www.ncbi.nlm.nih.gov/pubmed/21581923
http://dx.doi.org/10.1107/S1600536809001123
_version_ 1782189836632850432
author Bebout, Deborah
Pagola, Silvina
author_facet Bebout, Deborah
Pagola, Silvina
author_sort Bebout, Deborah
collection PubMed
description The crystal structure of the title compound (systematic name: methyl 3,4,5-trihydroxy­benzoate), C(8)H(8)O(5), is composed of essentially planar mol­ecules [maximum departures from the mean carbon and oxygen skeleton plane of 0.0348 (10) Å]. The H atoms of the three hydroxyl groups, which function as hydrogen-bond donors and acceptors simultaneously, are oriented in the same direction around the aromatic ring. In addition to two intra­molecular hydrogen bonds, each mol­ecule is hydrogen bonded to six others, creating a three-dimensional hydrogen-bonded network.
format Text
id pubmed-2968310
institution National Center for Biotechnology Information
language English
publishDate 2009
publisher International Union of Crystallography
record_format MEDLINE/PubMed
spelling pubmed-29683102010-12-30 Methyl gallate Bebout, Deborah Pagola, Silvina Acta Crystallogr Sect E Struct Rep Online Organic Papers The crystal structure of the title compound (systematic name: methyl 3,4,5-trihydroxy­benzoate), C(8)H(8)O(5), is composed of essentially planar mol­ecules [maximum departures from the mean carbon and oxygen skeleton plane of 0.0348 (10) Å]. The H atoms of the three hydroxyl groups, which function as hydrogen-bond donors and acceptors simultaneously, are oriented in the same direction around the aromatic ring. In addition to two intra­molecular hydrogen bonds, each mol­ecule is hydrogen bonded to six others, creating a three-dimensional hydrogen-bonded network. International Union of Crystallography 2009-01-14 /pmc/articles/PMC2968310/ /pubmed/21581923 http://dx.doi.org/10.1107/S1600536809001123 Text en © Bebout and Pagola 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
Bebout, Deborah
Pagola, Silvina
Methyl gallate
title Methyl gallate
title_full Methyl gallate
title_fullStr Methyl gallate
title_full_unstemmed Methyl gallate
title_short Methyl gallate
title_sort methyl gallate
topic Organic Papers
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC2968310/
https://www.ncbi.nlm.nih.gov/pubmed/21581923
http://dx.doi.org/10.1107/S1600536809001123
work_keys_str_mv AT beboutdeborah methylgallate
AT pagolasilvina methylgallate

Ejemplares similares