tert-Butyl 2-benzoyl-2-methylpropanoate
The title compound, C(15)H(20)O(3), is bent with a dihedral angle of 67.28 (9)° between the mean planes of the phenyl ring and a group encompassing the ester functionality (O=C—O—C). In the crystal, molecules related by inversion symmetry are connected by weak C—H⋯O interactions into infinite chai...
Autores principales: | , , , , , , |
---|---|
Formato: | Texto |
Lenguaje: | English |
Publicado: |
International Union of Crystallography
2010
|
Materias: | |
Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC2979963/ https://www.ncbi.nlm.nih.gov/pubmed/21579896 http://dx.doi.org/10.1107/S1600536810003120 |
_version_ | 1782191544290246656 |
---|---|
author | Logue, Marshall W. Luck, Rudy L. Maynard, Nicklaus S. Orlowski, Sandra S. Pignotti, Louis R. Putman, Annie L. Whelan, Kelli M. |
author_facet | Logue, Marshall W. Luck, Rudy L. Maynard, Nicklaus S. Orlowski, Sandra S. Pignotti, Louis R. Putman, Annie L. Whelan, Kelli M. |
author_sort | Logue, Marshall W. |
collection | PubMed |
description | The title compound, C(15)H(20)O(3), is bent with a dihedral angle of 67.28 (9)° between the mean planes of the phenyl ring and a group encompassing the ester functionality (O=C—O—C). In the crystal, molecules related by inversion symmetry are connected by weak C—H⋯O interactions into infinite chains. On one side of the molecule there are two adjacent interactions between neighbouring molecules involving the H atoms of methyl groups from the dimethyl groups and the O atoms of the ketone; on the other side, there are also two interactions to another adjacent molecule involving the H atoms on the phenyl rings and the carbonyl O atoms of the ester functionality. |
format | Text |
id | pubmed-2979963 |
institution | National Center for Biotechnology Information |
language | English |
publishDate | 2010 |
publisher | International Union of Crystallography |
record_format | MEDLINE/PubMed |
spelling | pubmed-29799632010-12-30 tert-Butyl 2-benzoyl-2-methylpropanoate Logue, Marshall W. Luck, Rudy L. Maynard, Nicklaus S. Orlowski, Sandra S. Pignotti, Louis R. Putman, Annie L. Whelan, Kelli M. Acta Crystallogr Sect E Struct Rep Online Organic Papers The title compound, C(15)H(20)O(3), is bent with a dihedral angle of 67.28 (9)° between the mean planes of the phenyl ring and a group encompassing the ester functionality (O=C—O—C). In the crystal, molecules related by inversion symmetry are connected by weak C—H⋯O interactions into infinite chains. On one side of the molecule there are two adjacent interactions between neighbouring molecules involving the H atoms of methyl groups from the dimethyl groups and the O atoms of the ketone; on the other side, there are also two interactions to another adjacent molecule involving the H atoms on the phenyl rings and the carbonyl O atoms of the ester functionality. International Union of Crystallography 2010-01-30 /pmc/articles/PMC2979963/ /pubmed/21579896 http://dx.doi.org/10.1107/S1600536810003120 Text en © Logue 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 Logue, Marshall W. Luck, Rudy L. Maynard, Nicklaus S. Orlowski, Sandra S. Pignotti, Louis R. Putman, Annie L. Whelan, Kelli M. tert-Butyl 2-benzoyl-2-methylpropanoate |
title |
tert-Butyl 2-benzoyl-2-methylpropanoate |
title_full |
tert-Butyl 2-benzoyl-2-methylpropanoate |
title_fullStr |
tert-Butyl 2-benzoyl-2-methylpropanoate |
title_full_unstemmed |
tert-Butyl 2-benzoyl-2-methylpropanoate |
title_short |
tert-Butyl 2-benzoyl-2-methylpropanoate |
title_sort | tert-butyl 2-benzoyl-2-methylpropanoate |
topic | Organic Papers |
url | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC2979963/ https://www.ncbi.nlm.nih.gov/pubmed/21579896 http://dx.doi.org/10.1107/S1600536810003120 |
work_keys_str_mv | AT loguemarshallw tertbutyl2benzoyl2methylpropanoate AT luckrudyl tertbutyl2benzoyl2methylpropanoate AT maynardnicklauss tertbutyl2benzoyl2methylpropanoate AT orlowskisandras tertbutyl2benzoyl2methylpropanoate AT pignottilouisr tertbutyl2benzoyl2methylpropanoate AT putmananniel tertbutyl2benzoyl2methylpropanoate AT whelankellim tertbutyl2benzoyl2methylpropanoate |