CAS 750649-39-9

Carbamic acid, [(1R,3R)-3-hydroxycyclohexyl]-, phenylmethyl ester, rel-

Description:

Carbamic acid, [(1R,3R)-3-hydroxycyclohexyl]-, phenylmethyl ester, with the CAS number 750649-39-9, is an organic compound characterized by its carbamate functional group. This substance features a cyclohexane ring with a hydroxyl group at the 3-position, contributing to its stereochemistry and potential for hydrogen bonding. The phenylmethyl ester moiety indicates that it has a phenyl group attached to a methyl group, which enhances its lipophilicity and may influence its biological activity. The compound's structure suggests it may exhibit properties typical of carbamates, such as potential neuroactivity or use as a pesticide or pharmaceutical intermediate. Its stereochemistry, particularly the (1R,3R) configuration, can significantly affect its reactivity and interaction with biological systems. As with many carbamates, it may be sensitive to hydrolysis, and its stability can be influenced by environmental conditions. Safety data and handling precautions should be considered, as carbamates can exhibit varying degrees of toxicity.

Formula: C₁₄H₁₉NO₃

InChI: InChI=1/C14H19NO3/c16-13-8-4-7-12(9-13)15-14(17)18-10-11-5-2-1-3-6-11/h1-3,5-6,12-13,16H,4,7-10H2,(H,15,17)/t12-,13-/s2

InChI key: InChIKey=FYIZIYCXUSGNLZ-NVHKGDCHNA-N

SMILES: N(C(OCC1=CC=CC=C1)=O)[C@@H]2C[C@@H](O)CCC2

Synonyms:

• Carbamic acid, [(1R,3R)-3-hydroxycyclohexyl]-, phenylmethyl ester, rel-