Single-crystal X-ray study T = 296 K Mean (C-C) = 0.004 A Disorder in main residue R factor = 0.065 wR factor = 0.175 Data-to-parameter ratio = 16.3 For details of how these key indicators were automatically derived from the article, see http://journals.iucr.org/e.
3-(1,3-Benzodioxol-5-yl)-3-hydroxy-N-methyl-N-phenylpropionamide
✍ Scribed by Yu, Zhi-Fang ;Li, Juan ;Zhao, Zhi-Min
- Publisher
- International Union of Crystallography
- Year
- 2006
- Tongue
- English
- Weight
- 76 KB
- Volume
- 62
- Category
- Article
- ISSN
- 1600-5368
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✦ Synopsis
The title compound, C 17 H 17 NO 4 , was synthesized by the Reformatsky reaction of 1,3-benzodioxole-5-carbaldehyde and N-methyl-N-phenylcarbamic bromide. The two benzene rings are inclined at a dihedral angle of 50.6 (3) .
📜 SIMILAR VOLUMES
The structure of the title compound, C 18 H 14 F 4 N 2 O 2 S, consists of molecules that pack in a linear hydrogen-bonded chain along the c axis. This hydrogen-bonding arrangement involves the hydroxy group and one of the sulfonyl O atoms.
The title compound, C~9~H~15~NOS, was prepared by the reduction of 2-thienyl 2-(dimethylamino)ethyl ketone hydrochloride with sodium borohydride. In the crystal structure, O—H...N hydrogen bonds link pairs of molecules into centrosymmetric dimers.
The molecular structure of (I), showing 50% probability displacement ellipsoids and the atom-numbering scheme.
The title compound, C 14 H 17 NO 3 , is a natural product which can be isolated from many plants. In the molecule, the amide group adopts a planar Z geometry.