(1R,2R)-2-(2,4-Dimethylbenzoyl)cyclohexanecarboxylic acid
[CAS# 733742-81-9]

Identification

• Name: (1R,2R)-2-(2,4-Dimethylbenzoyl)cyclohexanecarboxylic acid
• Synonyms: trans-2-(2,4-dimethylbenzoyl)cyclohexane-1-carboxylic acid
• Molecular Formula: C₁₆H₂₀O₃
• Molecular Weight: 260.33
• CAS Registry Number: 733742-81-9
• SMILES: O=C([C@@H]1CCCC[C@H]1C(O)=O)c2ccc(C)cc2C
• InChI: 1S/C16H20O3/c1-10-7-8-12(11(2)9-10)15(17)13-5-3-4-6-14(13)16(18)19/h7-9,13-14H,3-6H2,1-2H3,(H,18,19)/t13-,14-/m1/s1
• InChIKey: LOMSWNKAZFZYCV-ZIAGYGMSSA-N

Properties

• Density: 1.14g/cm³ (Cal.)
• Boiling point: 436.947°C at 760 mmHg (Cal.)
• Flash point: 232.194°C (Cal.)
• Refractive index: 1.553 (Cal.)