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2-(1,3-Dioxoisoindolin-2-yl)ethyl 4-methylbenzenesulfonate
In the title molecule, C(17)H(15)NO(5)S, the dihedral angle between the essentially planar atoms of the tosyl moiety (the S atom and the seven tolyl C atoms) and the phthalimide moiety is 6.089 (3)°. The molecule is folded about the ethylene bridge, adopting a staggered conformation such that the...
Autores principales: | , , |
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Formato: | Texto |
Lenguaje: | English |
Publicado: |
International Union of Crystallography
2008
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Materias: | |
Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC2960049/ https://www.ncbi.nlm.nih.gov/pubmed/21581365 http://dx.doi.org/10.1107/S1600536808037951 |
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author | Bartholomä, Mark Daniel Ouellette, Wayne Zubieta, Jon |
author_facet | Bartholomä, Mark Daniel Ouellette, Wayne Zubieta, Jon |
author_sort | Bartholomä, Mark Daniel |
collection | PubMed |
description | In the title molecule, C(17)H(15)NO(5)S, the dihedral angle between the essentially planar atoms of the tosyl moiety (the S atom and the seven tolyl C atoms) and the phthalimide moiety is 6.089 (3)°. The molecule is folded about the ethylene bridge, adopting a staggered conformation such that the benzene ring of the tosyl group and the five-membered ring of the phthalimide moiety have a face-to-face orientation with a centroid-to-centroid separation of 3.7454 (12) Å. The crystal structure is stabilized by weak intermolecular π–π interactions between symmetry-related five-membered rings of the phthalimide groups, with a centroid-to-centroid distance of 3.3867 (11) Å. The compound is used for the attachment of a suitable chelate functionality for radiolabeling purposes. |
format | Text |
id | pubmed-2960049 |
institution | National Center for Biotechnology Information |
language | English |
publishDate | 2008 |
publisher | International Union of Crystallography |
record_format | MEDLINE/PubMed |
spelling | pubmed-29600492010-12-30 2-(1,3-Dioxoisoindolin-2-yl)ethyl 4-methylbenzenesulfonate Bartholomä, Mark Daniel Ouellette, Wayne Zubieta, Jon Acta Crystallogr Sect E Struct Rep Online Organic Papers In the title molecule, C(17)H(15)NO(5)S, the dihedral angle between the essentially planar atoms of the tosyl moiety (the S atom and the seven tolyl C atoms) and the phthalimide moiety is 6.089 (3)°. The molecule is folded about the ethylene bridge, adopting a staggered conformation such that the benzene ring of the tosyl group and the five-membered ring of the phthalimide moiety have a face-to-face orientation with a centroid-to-centroid separation of 3.7454 (12) Å. The crystal structure is stabilized by weak intermolecular π–π interactions between symmetry-related five-membered rings of the phthalimide groups, with a centroid-to-centroid distance of 3.3867 (11) Å. The compound is used for the attachment of a suitable chelate functionality for radiolabeling purposes. International Union of Crystallography 2008-11-20 /pmc/articles/PMC2960049/ /pubmed/21581365 http://dx.doi.org/10.1107/S1600536808037951 Text en © Bartholomä et al. 2008 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 Bartholomä, Mark Daniel Ouellette, Wayne Zubieta, Jon 2-(1,3-Dioxoisoindolin-2-yl)ethyl 4-methylbenzenesulfonate |
title | 2-(1,3-Dioxoisoindolin-2-yl)ethyl 4-methylbenzenesulfonate |
title_full | 2-(1,3-Dioxoisoindolin-2-yl)ethyl 4-methylbenzenesulfonate |
title_fullStr | 2-(1,3-Dioxoisoindolin-2-yl)ethyl 4-methylbenzenesulfonate |
title_full_unstemmed | 2-(1,3-Dioxoisoindolin-2-yl)ethyl 4-methylbenzenesulfonate |
title_short | 2-(1,3-Dioxoisoindolin-2-yl)ethyl 4-methylbenzenesulfonate |
title_sort | 2-(1,3-dioxoisoindolin-2-yl)ethyl 4-methylbenzenesulfonate |
topic | Organic Papers |
url | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC2960049/ https://www.ncbi.nlm.nih.gov/pubmed/21581365 http://dx.doi.org/10.1107/S1600536808037951 |
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