Publication: Crystal structure of 1-(2,4-dihydroxy-6-methylphenyl)ethanone
Issued Date
2015-01-01
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ISSN
20569890
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2-s2.0-84976495413
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Mahidol University
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SCOPUS
Bibliographic Citation
Acta Crystallographica Section E: Crystallographic Communications. Vol.71, (2015), o612-o613
Suggested Citation
Samran Prabpai, Palangpon Kongsaeree Crystal structure of 1-(2,4-dihydroxy-6-methylphenyl)ethanone. Acta Crystallographica Section E: Crystallographic Communications. Vol.71, (2015), o612-o613. doi:10.1107/S2056989015013468 Retrieved from: https://repository.li.mahidol.ac.th/handle/20.500.14594/35769
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Title
Crystal structure of 1-(2,4-dihydroxy-6-methylphenyl)ethanone
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Abstract
The title compound, C9H10O3, is a bioactive secondary metabolite, isolated from the endophytic fungus Nodulis-porium sp. The compound exhibits an intramolecular O-H···O hydrogen bond between the phenolic H atom and the carbonyl O atom of the adjacent acetyl group. In the crystal, molecules are linked by hydrogen bonds involving the 4-phenolic H atom and a symmetry-related carbonyl O atom of a neighboring molecule, resulting in extended supramolecular chains along the a-axis direction. Aromatic π-π stacking interactions between the nearly parallel benzene rings of adjacent chains [centroid-centroid distance = 3.7478 (8) Å] further stabilize the three-dimensional supramolecular frame-work.