(1R,3S)-3-[2-(4-Methylphenyl)-2-oxoethyl]cyclopentanecarboxylic acid
[CAS# 733740-26-6]

Identification

• Name: (1R,3S)-3-[2-(4-Methylphenyl)-2-oxoethyl]cyclopentanecarboxylic acid
• Synonyms: cis-3-[2-(4-methylphenyl)-2-oxoethyl]cyclopentane-1-carboxylic acid
• Molecular Formula: C₁₅H₁₈O₃
• Molecular Weight: 246.30
• CAS Registry Number: 733740-26-6
• SMILES: O=C(O)[C@H]2C[C@@H](CC(=O)c1ccc(C)cc1)CC2
• InChI: 1S/C15H18O3/c1-10-2-5-12(6-3-10)14(16)9-11-4-7-13(8-11)15(17)18/h2-3,5-6,11,13H,4,7-9H2,1H3,(H,17,18)/t11-,13+/m0/s1
• InChIKey: BYTVBMWKXJZNBJ-WCQYABFASA-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.)