(1R,3S)-3-[2-(4-Iodophenyl)-2-oxoethyl]cyclohexanecarboxylic acid
[CAS# 735275-39-5]

Identification

• Name: (1R,3S)-3-[2-(4-Iodophenyl)-2-oxoethyl]cyclohexanecarboxylic acid
• Synonyms: cis-3-[2-(4-iodophenyl)-2-oxoethyl]cyclohexane-1-carboxylic acid
• Molecular Formula: C₁₅H₁₇IO₃
• Molecular Weight: 372.20
• CAS Registry Number: 735275-39-5
• SMILES: O=C(C[C@@H]1C[C@@H](CCC1)C(O)=O)c2ccc(I)cc2
• InChI: 1S/C15H17IO3/c16-13-6-4-11(5-7-13)14(17)9-10-2-1-3-12(8-10)15(18)19/h4-7,10,12H,1-3,8-9H2,(H,18,19)/t10-,12+/m0/s1
• InChIKey: BRTJQTYCGVEPNG-CMPLNLGQSA-N

Properties

• Density: 1.565g/cm³ (Cal.)
• Boiling point: 489.742°C at 760 mmHg (Cal.)
• Flash point: 249.987°C (Cal.)
• Refractive index: 1.596 (Cal.)