Methyl 6-amino-6-oxohexa­noate

The title compound, C(7)H(13)NO(3), adopts an approximately planar conformation. The torsion angles in the aliphatic chain between the carbonyl group C atoms range from 172.97 (14) to 179.38 (14)° and the r.m.s. deviation of all non-H atoms is 0.059 Å. The crystal packing is dominated by two strong...

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Detalles Bibliográficos
Autores principales: Gruber, Tobias, Schofield, Christopher J., Thompson, Amber L.
Formato: Online Artículo Texto
Lenguaje:English
Publicado: International Union of Crystallography 2012
Materias:
Organic Papers
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3297318/
https://www.ncbi.nlm.nih.gov/pubmed/22412508
http://dx.doi.org/10.1107/S1600536812003303
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author Gruber, Tobias
Schofield, Christopher J.
Thompson, Amber L.
author_facet Gruber, Tobias
Schofield, Christopher J.
Thompson, Amber L.
author_sort Gruber, Tobias
collection PubMed
description The title compound, C(7)H(13)NO(3), adopts an approximately planar conformation. The torsion angles in the aliphatic chain between the carbonyl group C atoms range from 172.97 (14) to 179.38 (14)° and the r.m.s. deviation of all non-H atoms is 0.059 Å. The crystal packing is dominated by two strong N—H⋯O hydrogen bonds involving the amide groups and forming R (2) (2)(8) rings and C(4) chains. Overall, a two-dimensional network parallel to (100) is formed. A weak inter­molecular C—H⋯O inter­action is also present.
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spelling pubmed-32973182012-03-12 Methyl 6-amino-6-oxohexa­noate Gruber, Tobias Schofield, Christopher J. Thompson, Amber L. Acta Crystallogr Sect E Struct Rep Online Organic Papers The title compound, C(7)H(13)NO(3), adopts an approximately planar conformation. The torsion angles in the aliphatic chain between the carbonyl group C atoms range from 172.97 (14) to 179.38 (14)° and the r.m.s. deviation of all non-H atoms is 0.059 Å. The crystal packing is dominated by two strong N—H⋯O hydrogen bonds involving the amide groups and forming R (2) (2)(8) rings and C(4) chains. Overall, a two-dimensional network parallel to (100) is formed. A weak inter­molecular C—H⋯O inter­action is also present. International Union of Crystallography 2012-02-04 /pmc/articles/PMC3297318/ /pubmed/22412508 http://dx.doi.org/10.1107/S1600536812003303 Text en © Gruber et al. 2012 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
Gruber, Tobias
Schofield, Christopher J.
Thompson, Amber L.
Methyl 6-amino-6-oxohexa­noate
title Methyl 6-amino-6-oxohexa­noate
title_full Methyl 6-amino-6-oxohexa­noate
title_fullStr Methyl 6-amino-6-oxohexa­noate
title_full_unstemmed Methyl 6-amino-6-oxohexa­noate
title_short Methyl 6-amino-6-oxohexa­noate
title_sort methyl 6-amino-6-oxohexa­noate
topic Organic Papers
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3297318/
https://www.ncbi.nlm.nih.gov/pubmed/22412508
http://dx.doi.org/10.1107/S1600536812003303
work_keys_str_mv AT grubertobias methyl6amino6oxohexanoate
AT schofieldchristopherj methyl6amino6oxohexanoate
AT thompsonamberl methyl6amino6oxohexanoate

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