(1R,2S)-2-[2-(3-Fluorophenyl)-2-oxoethyl]cyclohexanecarboxylic acid
[CAS# 735274-90-5]

Identification

• Name: (1R,2S)-2-[2-(3-Fluorophenyl)-2-oxoethyl]cyclohexanecarboxylic acid
• Synonyms: trans-2-[2-(3-fluorophenyl)-2-oxoethyl]cyclohexane-1-carboxylic acid
• Molecular Formula: C₁₅H₁₇FO₃
• Molecular Weight: 264.29
• CAS Registry Number: 735274-90-5
• SMILES: O=C(O)[C@@H]2CCCC[C@H]2CC(=O)c1cccc(F)c1
• InChI: 1S/C15H17FO3/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: HKQMYZIHQYRFEN-GXFFZTMASA-N

Properties

• Density: 1.202g/cm³ (Cal.)
• Boiling point: 424.707°C at 760 mmHg (Cal.)
• Flash point: 210.655°C (Cal.)
• Refractive index: 1.531 (Cal.)