(1R,2R)-2-(3-Methylbenzoyl)cyclopentanecarboxylic acid
[CAS# 733740-80-2]

Identification

• Name: (1R,2R)-2-(3-Methylbenzoyl)cyclopentanecarboxylic acid
• Synonyms: trans-2-(3-Methylbenzoyl)cyclopentane-1-carboxylic acid
• Molecular Formula: C₁₄H₁₆O₃
• Molecular Weight: 232.27
• CAS Registry Number: 733740-80-2
• SMILES: O=C([C@@H]1CCC[C@H]1C(=O)O)c2cccc(C)c2
• InChI: 1S/C14H16O3/c1-9-4-2-5-10(8-9)13(15)11-6-3-7-12(11)14(16)17/h2,4-5,8,11-12H,3,6-7H2,1H3,(H,16,17)/t11-,12-/m1/s1
• InChIKey: LCRAIEWQRNEROC-VXGBXAGGSA-N

Properties

• Density: 1.196g/cm³ (Cal.)
• Boiling point: 412.849°C at 760 mmHg (Cal.)
• Flash point: 217.637°C (Cal.)
• Refractive index: 1.568 (Cal.)