(1R,2R)-2-[2-(3-Bromophenyl)-2-oxoethyl]cyclohexanecarboxylic acid
[CAS# 736136-38-2]

Identification

• Name: (1R,2R)-2-[2-(3-Bromophenyl)-2-oxoethyl]cyclohexanecarboxylic acid
• Synonyms: cis-2-[2-(3-bromophenyl)-2-oxoethyl]cyclohexane-1-carboxylic acid
• Molecular Formula: C₁₅H₁₇BrO₃
• Molecular Weight: 325.20
• CAS Registry Number: 736136-38-2
• SMILES: O=C(O)[C@@H]2CCCC[C@@H]2CC(=O)c1cccc(Br)c1
• InChI: 1S/C15H17BrO3/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-/m1/s1
• InChIKey: HXMGBTCEMUDHJI-ZWNOBZJWSA-N

Properties

• Density: 1.402g/cm³ (Cal.)
• Boiling point: 471.893°C at 760 mmHg (Cal.)
• Flash point: 239.192°C (Cal.)
• Refractive index: 1.567 (Cal.)