3,5,5-Trimethyl-2-(2-Propenyl)-2-Cyclohexen-1-One
[CAS# 53543-47-8]

Identification

• Name: 3,5,5-Trimethyl-2-(2-Propenyl)-2-Cyclohexen-1-One
• Synonyms: 2-Allyl-3,5,5-Trimethyl-Cyclohex-2-En-1-One; 2-Allyl-3,5,5-Trimethyl-1-Cyclohex-2-Enone; 3,5,5-Trimethyl-2-Prop-2-Enyl-Cyclohex-2-En-1-One
• Molecular Formula: C₁₂H₁₈O
• Molecular Weight: 178.27
• CAS Registry Number: 53543-47-8
• SMILES: C(C1=C(CC(CC1=O)(C)C)C)C=C
• InChI: 1S/C12H18O/c1-5-6-10-9(2)7-12(3,4)8-11(10)13/h5H,1,6-8H2,2-4H3
• InChIKey: FVUNTBDGUHBYRC-UHFFFAOYSA-N

Properties

• Density: 0.892g/cm³ (Cal.)
• Boiling point: 249.121°C at 760 mmHg (Cal.)
• Flash point: 106.761°C (Cal.)