4-Methyl-4-Phenyl-2-Cyclohexen-1-One
[CAS# 17429-36-6]

Identification

• Name: 4-Methyl-4-Phenyl-2-Cyclohexen-1-One
• Synonyms: 1-Methyl-2,3-dihydro-[1,1'-biphenyl]-4(1H)-one; 4-Methyl-4-phenyl-2-cyclohexen-1-one #; 4-methyl-4-phenylcyclohex-2-en-1-one
• Molecular Formula: C₁₃H₁₄O
• Molecular Weight: 186.25
• CAS Registry Number: 17429-36-6
• SMILES: O=C2\C=C/C(c1ccccc1)(C)CC2
• InChI: 1S/C13H14O/c1-13(9-7-12(14)8-10-13)11-5-3-2-4-6-11/h2-7,9H,8,10H2,1H3
• InChIKey: NTASQMWLMVNJSS-UHFFFAOYSA-N

Properties

• Density: 1.041g/cm³ (Cal.)
• Boiling point: 254.114°C at 760 mmHg (Cal.)
• Flash point: 107.13°C (Cal.)
• Refractive index: 1.544 (Cal.)