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6-(Hex-5-en­yloxy)naphthalene-2-carb­oxy­lic acid

The asymmetric unit of the title compound, C(17)H(18)O(3), comprises three independent mol­ecules with similar geometries. In each mol­ecule, the carbonyl group is twisted away from the napthalene ring system, making dihedral angles of 1.0 (2), 1.05 (19)° and 1.5 (2)°. The butene group in all three...

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Autores principales: Rahman, Md. Lutfor, Srinivasa, H. T., Mohd. Yusoff, Mashitah, Kwong, Huey Chong, Quah, Ching Kheng
Formato: Online Artículo Texto
Lenguaje:English
Publicado: International Union of Crystallography 2014
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4051067/
https://www.ncbi.nlm.nih.gov/pubmed/24940271
http://dx.doi.org/10.1107/S1600536814010642
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author Rahman, Md. Lutfor
Srinivasa, H. T.
Mohd. Yusoff, Mashitah
Kwong, Huey Chong
Quah, Ching Kheng
author_facet Rahman, Md. Lutfor
Srinivasa, H. T.
Mohd. Yusoff, Mashitah
Kwong, Huey Chong
Quah, Ching Kheng
author_sort Rahman, Md. Lutfor
collection PubMed
description The asymmetric unit of the title compound, C(17)H(18)O(3), comprises three independent mol­ecules with similar geometries. In each mol­ecule, the carbonyl group is twisted away from the napthalene ring system, making dihedral angles of 1.0 (2), 1.05 (19)° and 1.5 (2)°. The butene group in all three mol­ecules are disordered over two sets of sites, with a refined occupancy ratio of 0.664 (6):0.336 (6). In the crystal, mol­ecules are oriented with respect to their carbonyl groups, forming head-to-head dimers via O—H⋯O hydrogen bonds. Adjacent dimers are further inter­connected by C—H⋯O hydrogen bonds into chains along the a-axis direction. The crystal structure is further stabilized by weak C—H⋯π inter­actions.
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spelling pubmed-40510672014-06-17 6-(Hex-5-en­yloxy)naphthalene-2-carb­oxy­lic acid Rahman, Md. Lutfor Srinivasa, H. T. Mohd. Yusoff, Mashitah Kwong, Huey Chong Quah, Ching Kheng Acta Crystallogr Sect E Struct Rep Online Organic Papers The asymmetric unit of the title compound, C(17)H(18)O(3), comprises three independent mol­ecules with similar geometries. In each mol­ecule, the carbonyl group is twisted away from the napthalene ring system, making dihedral angles of 1.0 (2), 1.05 (19)° and 1.5 (2)°. The butene group in all three mol­ecules are disordered over two sets of sites, with a refined occupancy ratio of 0.664 (6):0.336 (6). In the crystal, mol­ecules are oriented with respect to their carbonyl groups, forming head-to-head dimers via O—H⋯O hydrogen bonds. Adjacent dimers are further inter­connected by C—H⋯O hydrogen bonds into chains along the a-axis direction. The crystal structure is further stabilized by weak C—H⋯π inter­actions. International Union of Crystallography 2014-05-24 /pmc/articles/PMC4051067/ /pubmed/24940271 http://dx.doi.org/10.1107/S1600536814010642 Text en © Rahman et al. 2014 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
Rahman, Md. Lutfor
Srinivasa, H. T.
Mohd. Yusoff, Mashitah
Kwong, Huey Chong
Quah, Ching Kheng
6-(Hex-5-en­yloxy)naphthalene-2-carb­oxy­lic acid
title 6-(Hex-5-en­yloxy)naphthalene-2-carb­oxy­lic acid
title_full 6-(Hex-5-en­yloxy)naphthalene-2-carb­oxy­lic acid
title_fullStr 6-(Hex-5-en­yloxy)naphthalene-2-carb­oxy­lic acid
title_full_unstemmed 6-(Hex-5-en­yloxy)naphthalene-2-carb­oxy­lic acid
title_short 6-(Hex-5-en­yloxy)naphthalene-2-carb­oxy­lic acid
title_sort 6-(hex-5-en­yloxy)naphthalene-2-carb­oxy­lic acid
topic Organic Papers
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4051067/
https://www.ncbi.nlm.nih.gov/pubmed/24940271
http://dx.doi.org/10.1107/S1600536814010642
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