(1R,3S)-3-{2-Oxo-2-[4-(trifluoromethyl)phenyl]ethyl}cyclopentanecarboxylic acid
[CAS# 733740-47-1]

Identification

• Name: (1R,3S)-3-{2-Oxo-2-[4-(trifluoromethyl)phenyl]ethyl}cyclopentanecarboxylic acid
• Synonyms: cis-3-[2-oxo-2-(4-trifluoromethylphenyl)ethyl]cyclopentane-1-carboxylic acid
• Molecular Formula: C₁₅H₁₅F₃O₃
• Molecular Weight: 300.27
• CAS Registry Number: 733740-47-1
• SMILES: O=C(O)[C@H]2C[C@@H](CC(=O)c1ccc(cc1)C(F)(F)F)CC2
• InChI: 1S/C15H15F3O3/c16-15(17,18)12-5-3-10(4-6-12)13(19)8-9-1-2-11(7-9)14(20)21/h3-6,9,11H,1-2,7-8H2,(H,20,21)/t9-,11+/m0/s1
• InChIKey: JBHBXUHEXGXHEJ-GXSJLCMTSA-N

Properties

• Density: 1.297g/cm³ (Cal.)
• Boiling point: 423.226°C at 760 mmHg (Cal.)
• Flash point: 209.76°C (Cal.)
• Refractive index: 1.503 (Cal.)