5,5-Dimethyl-3-(4-Methylphenyl)Cyclohex-2-En-1-One
[CAS# 72036-52-3]

Identification

• Name: 5,5-Dimethyl-3-(4-Methylphenyl)Cyclohex-2-En-1-One
• Synonyms: 5,5-Dimethyl-3-(4-Methylphenyl)-1-Cyclohex-2-Enone; 5,5-Dimethyl-3-(4-Methylphenyl)-Cyclohex-2-En-1-One; 5,5-Dimethyl-3-(4-Methylphenyl)Cyclohex-2-Enone
• Molecular Formula: C₁₅H₁₈O
• Molecular Weight: 214.31
• CAS Registry Number: 72036-52-3
• SMILES: C2=C(C1=CC(=O)CC(C1)(C)C)C=CC(=C2)C
• InChI: 1S/C15H18O/c1-11-4-6-12(7-5-11)13-8-14(16)10-15(2,3)9-13/h4-8H,9-10H2,1-3H3
• InChIKey: VBVILNYBMHFOQS-UHFFFAOYSA-N

Properties

• Density: 1.006g/cm³ (Cal.)
• Boiling point: 311.526°C at 760 mmHg (Cal.)
• Flash point: 136.976°C (Cal.)