5-Hydroxy-7-phenyl-5-(prop-2-yn-1-yl)-5,6-dihydro-1-benzofuran-2(4 H )-one monohydrate

In the title compound, C17H14O3·H2O, the six-membered ring, which adopts a half-chair conformation, makes a dihedral angle of 24.3 (2)° with the phenyl ring. In the crystal, the components are linked by O—H...O hydrogen bonds involving the water molecule, and th...

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Veröffentlicht in:Acta crystallographica. Section E, Structure reports online Structure reports online, 2010-11, Vol.66 (11), p.o2834-o2834
Hauptverfasser: Torre-Fernández, Laura, Suero, Marcos G., García-Granda, Santiago
Format: Artikel
Sprache:eng
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Zusammenfassung:In the title compound, C17H14O3·H2O, the six-membered ring, which adopts a half-chair conformation, makes a dihedral angle of 24.3 (2)° with the phenyl ring. In the crystal, the components are linked by O—H...O hydrogen bonds involving the water molecule, and the hydroxy and carbonyl groups of the organic compound. These interactions form a square-like supramolecular synthon unit which propagates as chains parallel to the crystallographic b axis. A C—H...O interaction also occurs.
ISSN:1600-5368
1600-5368
DOI:10.1107/S1600536810028400