(1R,6S)-6-(Cyclohexylcarbamoyl)Cyclohex-3-Ene-1-carboxylic acid
[CAS# 428841-22-9]

Identification

• Name: (1R,6S)-6-(Cyclohexylcarbamoyl)Cyclohex-3-Ene-1-carboxylic acid
• Synonyms: (1R,6S)-6-[(Cyclohexylamino)-Oxomethyl]-1-Cyclohex-3-Enecarboxylate; Zinc00301797
• Molecular Formula: C₁₄H₂₀NO₃
• Molecular Weight: 250.32
• CAS Registry Number: 428841-22-9
• SMILES: [C@H]1([C@H](C([O-])=O)CC=CC1)C(=O)NC2CCCCC2
• InChI: 1S/C14H21NO3/c16-13(15-10-6-2-1-3-7-10)11-8-4-5-9-12(11)14(17)18/h4-5,10-12H,1-3,6-9H2,(H,15,16)(H,17,18)/p-1/t11-,12+/m0/s1
• InChIKey: MPPQLTASDYNLKZ-NWDGAFQWSA-M

Properties

• Boiling point: 495.055°C at 760 mmHg (Cal.)
• Flash point: 253.201°C (Cal.)