(1R,2S)-2-[2-(4-Methylphenyl)-2-oxoethyl]cyclopentanecarboxylic acid
[CAS# 733740-54-0]

Identification

• Name: (1R,2S)-2-[2-(4-Methylphenyl)-2-oxoethyl]cyclopentanecarboxylic acid
• Synonyms: trans-2-[2-(4-methylphenyl)-2-oxoethyl]cyclopentane-1-carboxylic acid
• Molecular Formula: C₁₅H₁₈O₃
• Molecular Weight: 246.30
• CAS Registry Number: 733740-54-0
• SMILES: O=C(O)[C@@H]2CCC[C@H]2CC(=O)c1ccc(C)cc1
• InChI: 1S/C15H18O3/c1-10-5-7-11(8-6-10)14(16)9-12-3-2-4-13(12)15(17)18/h5-8,12-13H,2-4,9H2,1H3,(H,17,18)/t12-,13+/m0/s1
• InChIKey: RSWKQPLRONUBRY-QWHCGFSZSA-N

Properties

• Density: 1.15g/cm³ (Cal.)
• Boiling point: 424.273°C at 760 mmHg (Cal.)
• Flash point: 224.538°C (Cal.)
• Refractive index: 1.55 (Cal.)