3-(4-Fluorophenyl)-5,5-Dimethylcyclohex-2-En-1-One
[CAS# 72036-55-6]

Identification

• Name: 3-(4-Fluorophenyl)-5,5-Dimethylcyclohex-2-En-1-One
• Synonyms: 3-(4-Fluorophenyl)-5,5-Dimethyl-Cyclohex-2-En-1-One; 3-(4-Fluorophenyl)-5,5-Dimethyl-1-Cyclohex-2-Enone; 5,5-Dimethyl-3-(4-Fluorophenyl)Cyclohex-2-En-1-One
• Molecular Formula: C₁₄H₁₅FO
• Molecular Weight: 218.27
• CAS Registry Number: 72036-55-6
• SMILES: C2=C(C1=CC(=O)CC(C1)(C)C)C=CC(=C2)F
• InChI: 1S/C14H15FO/c1-14(2)8-11(7-13(16)9-14)10-3-5-12(15)6-4-10/h3-7H,8-9H2,1-2H3
• InChIKey: FTHQUDLJYHQIKT-UHFFFAOYSA-N

Properties

• Density: 1.086g/cm³ (Cal.)
• Boiling point: 290.204°C at 760 mmHg (Cal.)
• Flash point: 142.72°C (Cal.)