(1R,3S)-3-(3-Methoxybenzoyl)cyclohexanecarboxylic acid
[CAS# 735269-72-4]

Identification

• Name: (1R,3S)-3-(3-Methoxybenzoyl)cyclohexanecarboxylic acid
• Synonyms: cis-3-(3-Methoxybenzoyl)cyclohexane-1-carboxylic acid
• Molecular Formula: C₁₅H₁₈O₄
• Molecular Weight: 262.30
• CAS Registry Number: 735269-72-4
• SMILES: O=C(O)[C@H]1C[C@H](CCC1)C(=O)c2cccc(OC)c2
• InChI: 1S/C15H18O4/c1-19-13-7-3-5-11(9-13)14(16)10-4-2-6-12(8-10)15(17)18/h3,5,7,9-10,12H,2,4,6,8H2,1H3,(H,17,18)/t10-,12+/m0/s1
• InChIKey: WLLTZNKQSVRPKW-CMPLNLGQSA-N

Properties

• Density: 1.194g/cm³ (Cal.)
• Boiling point: 436.529°C at 760 mmHg (Cal.)
• Flash point: 162.488°C (Cal.)
• Refractive index: 1.551 (Cal.)