Cargando…
Crystal structure of 1-(8-methoxy-2H-chromen-3-yl)ethanone
In the structure of the title compound, C(12)H(12)O(3), the dihydropyran ring is fused with the benzene ring. The dihydropyran ring is in a half-chair conformation, with the ring O and methylene C atoms positioned 1.367 (3) and 1.504 (4) Å, respectively, on either side of the mean plane formed...
Autor principal: | |
---|---|
Formato: | Online Artículo Texto |
Lenguaje: | English |
Publicado: |
International Union of Crystallography
2014
|
Materias: | |
Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4186109/ https://www.ncbi.nlm.nih.gov/pubmed/25309264 http://dx.doi.org/10.1107/S1600536814016808 |
_version_ | 1782337998543650816 |
---|---|
author | Koh, Dongsoo |
author_facet | Koh, Dongsoo |
author_sort | Koh, Dongsoo |
collection | PubMed |
description | In the structure of the title compound, C(12)H(12)O(3), the dihydropyran ring is fused with the benzene ring. The dihydropyran ring is in a half-chair conformation, with the ring O and methylene C atoms positioned 1.367 (3) and 1.504 (4) Å, respectively, on either side of the mean plane formed by the other four atoms. The methoxy group is coplanar with the benzene ring to which it is connected [C(b)—Cb—O(m)—C(m) torsion angle = −0.2 (4)°; b = benzene and m = methoxy], and similarly the aldehyde is coplanar with respect to the double bond of the dihydropyran ring [C(dh)—C(dh)—C(a)—O(a) = −178.1 (3)°; dh = dihydropyran and a = aldehyde]. In the crystal, molecules are linked by weak methyl–methoxy C—H⋯O hydrogen bonds into supramolecular chains along the a-axis direction. |
format | Online Article Text |
id | pubmed-4186109 |
institution | National Center for Biotechnology Information |
language | English |
publishDate | 2014 |
publisher | International Union of Crystallography |
record_format | MEDLINE/PubMed |
spelling | pubmed-41861092014-10-12 Crystal structure of 1-(8-methoxy-2H-chromen-3-yl)ethanone Koh, Dongsoo Acta Crystallogr Sect E Struct Rep Online Data Reports In the structure of the title compound, C(12)H(12)O(3), the dihydropyran ring is fused with the benzene ring. The dihydropyran ring is in a half-chair conformation, with the ring O and methylene C atoms positioned 1.367 (3) and 1.504 (4) Å, respectively, on either side of the mean plane formed by the other four atoms. The methoxy group is coplanar with the benzene ring to which it is connected [C(b)—Cb—O(m)—C(m) torsion angle = −0.2 (4)°; b = benzene and m = methoxy], and similarly the aldehyde is coplanar with respect to the double bond of the dihydropyran ring [C(dh)—C(dh)—C(a)—O(a) = −178.1 (3)°; dh = dihydropyran and a = aldehyde]. In the crystal, molecules are linked by weak methyl–methoxy C—H⋯O hydrogen bonds into supramolecular chains along the a-axis direction. International Union of Crystallography 2014-08-01 /pmc/articles/PMC4186109/ /pubmed/25309264 http://dx.doi.org/10.1107/S1600536814016808 Text en © Dongsoo Koh 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 | Data Reports Koh, Dongsoo Crystal structure of 1-(8-methoxy-2H-chromen-3-yl)ethanone |
title | Crystal structure of 1-(8-methoxy-2H-chromen-3-yl)ethanone |
title_full | Crystal structure of 1-(8-methoxy-2H-chromen-3-yl)ethanone |
title_fullStr | Crystal structure of 1-(8-methoxy-2H-chromen-3-yl)ethanone |
title_full_unstemmed | Crystal structure of 1-(8-methoxy-2H-chromen-3-yl)ethanone |
title_short | Crystal structure of 1-(8-methoxy-2H-chromen-3-yl)ethanone |
title_sort | crystal structure of 1-(8-methoxy-2h-chromen-3-yl)ethanone |
topic | Data Reports |
url | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4186109/ https://www.ncbi.nlm.nih.gov/pubmed/25309264 http://dx.doi.org/10.1107/S1600536814016808 |
work_keys_str_mv | AT kohdongsoo crystalstructureof18methoxy2hchromen3ylethanone |