Cargando…

2-Isopropyl-5-methyl­cyclo­hexyl 5-acet­oxy-1,3-oxathiol­ane-2-carboxyl­ate

In the title compound, C(16)H(26)O(5)S, the oxathiol­ane ring adopts an envelope conformation, with the S atom 0.793 (3) Å out of the mean plane of the remaining four atoms. The cyclo­hexane ring of the menthol fragment adopts an almost ideal chair conformation, with all substituents in the equatori...

Descripción completa

Detalles Bibliográficos
Autores principales: Dutkiewicz, Grzegorz, Chidan Kumar, C. S., Yathirajan, H. S., Mayekar, A. N., Kubicki, Maciej
Formato: Texto
Lenguaje:English
Publicado: International Union of Crystallography 2009
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC2971831/
https://www.ncbi.nlm.nih.gov/pubmed/21578885
http://dx.doi.org/10.1107/S1600536809046492
_version_ 1782190679752966144
author Dutkiewicz, Grzegorz
Chidan Kumar, C. S.
Yathirajan, H. S.
Mayekar, A. N.
Kubicki, Maciej
author_facet Dutkiewicz, Grzegorz
Chidan Kumar, C. S.
Yathirajan, H. S.
Mayekar, A. N.
Kubicki, Maciej
author_sort Dutkiewicz, Grzegorz
collection PubMed
description In the title compound, C(16)H(26)O(5)S, the oxathiol­ane ring adopts an envelope conformation, with the S atom 0.793 (3) Å out of the mean plane of the remaining four atoms. The cyclo­hexane ring of the menthol fragment adopts an almost ideal chair conformation, with all substituents in the equatorial positions. In the crystal, relatively strong, short and linear C—H⋯O hydrogen bonds link the mol­ecules into the chains along [100] direction. The chains are packed into the crystal structure by means of weak dispersive inter­actions. Inter­molecular C—H⋯S inter­actions are also observed.
format Text
id pubmed-2971831
institution National Center for Biotechnology Information
language English
publishDate 2009
publisher International Union of Crystallography
record_format MEDLINE/PubMed
spelling pubmed-29718312010-12-30 2-Isopropyl-5-methyl­cyclo­hexyl 5-acet­oxy-1,3-oxathiol­ane-2-carboxyl­ate Dutkiewicz, Grzegorz Chidan Kumar, C. S. Yathirajan, H. S. Mayekar, A. N. Kubicki, Maciej Acta Crystallogr Sect E Struct Rep Online Organic Papers In the title compound, C(16)H(26)O(5)S, the oxathiol­ane ring adopts an envelope conformation, with the S atom 0.793 (3) Å out of the mean plane of the remaining four atoms. The cyclo­hexane ring of the menthol fragment adopts an almost ideal chair conformation, with all substituents in the equatorial positions. In the crystal, relatively strong, short and linear C—H⋯O hydrogen bonds link the mol­ecules into the chains along [100] direction. The chains are packed into the crystal structure by means of weak dispersive inter­actions. Inter­molecular C—H⋯S inter­actions are also observed. International Union of Crystallography 2009-11-21 /pmc/articles/PMC2971831/ /pubmed/21578885 http://dx.doi.org/10.1107/S1600536809046492 Text en © Dutkiewicz 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
Dutkiewicz, Grzegorz
Chidan Kumar, C. S.
Yathirajan, H. S.
Mayekar, A. N.
Kubicki, Maciej
2-Isopropyl-5-methyl­cyclo­hexyl 5-acet­oxy-1,3-oxathiol­ane-2-carboxyl­ate
title 2-Isopropyl-5-methyl­cyclo­hexyl 5-acet­oxy-1,3-oxathiol­ane-2-carboxyl­ate
title_full 2-Isopropyl-5-methyl­cyclo­hexyl 5-acet­oxy-1,3-oxathiol­ane-2-carboxyl­ate
title_fullStr 2-Isopropyl-5-methyl­cyclo­hexyl 5-acet­oxy-1,3-oxathiol­ane-2-carboxyl­ate
title_full_unstemmed 2-Isopropyl-5-methyl­cyclo­hexyl 5-acet­oxy-1,3-oxathiol­ane-2-carboxyl­ate
title_short 2-Isopropyl-5-methyl­cyclo­hexyl 5-acet­oxy-1,3-oxathiol­ane-2-carboxyl­ate
title_sort 2-isopropyl-5-methyl­cyclo­hexyl 5-acet­oxy-1,3-oxathiol­ane-2-carboxyl­ate
topic Organic Papers
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC2971831/
https://www.ncbi.nlm.nih.gov/pubmed/21578885
http://dx.doi.org/10.1107/S1600536809046492
work_keys_str_mv AT dutkiewiczgrzegorz 2isopropyl5methylcyclohexyl5acetoxy13oxathiolane2carboxylate
AT chidankumarcs 2isopropyl5methylcyclohexyl5acetoxy13oxathiolane2carboxylate
AT yathirajanhs 2isopropyl5methylcyclohexyl5acetoxy13oxathiolane2carboxylate
AT mayekaran 2isopropyl5methylcyclohexyl5acetoxy13oxathiolane2carboxylate
AT kubickimaciej 2isopropyl5methylcyclohexyl5acetoxy13oxathiolane2carboxylate