(1R,2S)-2-[2-(3-Chlorophenyl)-2-oxoethyl]cyclohexanecarboxylic acid
[CAS# 735274-89-2]

Identification

• Name: (1R,2S)-2-[2-(3-Chlorophenyl)-2-oxoethyl]cyclohexanecarboxylic acid
• Synonyms: trans-2-[2-(3-chlorophenyl)-2-oxoethyl]cyclohexane-1-carboxylic acid
• Molecular Formula: C₁₅H₁₇ClO₃
• Molecular Weight: 280.75
• CAS Registry Number: 735274-89-2
• SMILES: O=C(O)[C@@H]2CCCC[C@H]2CC(=O)c1cccc(Cl)c1
• InChI: 1S/C15H17ClO3/c16-12-6-3-5-11(8-12)14(17)9-10-4-1-2-7-13(10)15(18)19/h3,5-6,8,10,13H,1-2,4,7,9H2,(H,18,19)/t10-,13+/m0/s1
• InChIKey: VUDOUWMBJSNIEY-GXFFZTMASA-N

Properties

• Density: 1.233g/cm³ (Cal.)
• Boiling point: 457.812°C at 760 mmHg (Cal.)
• Flash point: 230.676°C (Cal.)
• Refractive index: 1.554 (Cal.)