X-ray Structure Analysis Online
Online ISSN : 1883-3578
ISSN-L : 1883-3578
Part 1
Crystal Structures of (1S,2R)-2-benzamidocyclohexane-1-calboxylic acid and [(1S,2R)-2-(benzylamino)cyclohexyl]methanol
Taira KIMINOIsao FUJII
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Supplementary material

2013 Volume 29 Pages 1-2

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Abstract
The crystal structures of optical resolving agents, (1S,2R)-2-(benzamido) cyclohexanecarboxylic acid (BACO) and its reduction product, (1S,2R)-2-(benzylamino)cyclohexanemethanol (BACH), were determined, and correlated with its physicochemical properties. The molecular structure in BACO is rigidly stabilized by the intramolecular hydrogen bond, but the tweeter-like structure in BACH is flexible. The results from thermal experiments essentially describe that the crystal form of BACO is more stable than that of BACH.
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© 2013 by The Japan Society for Analytical Chemistry
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