2,6,6-Trimethyl-2,4-Cyclohexadien-1-One
[CAS# 13487-30-4]

Identification

• Name: 2,6,6-Trimethyl-2,4-Cyclohexadien-1-One
• Synonyms: 2,6,6-Trimethyl-1-Cyclohexa-2,4-Dienone; 2,6,6-Trimethylcyclohexa-2,4-Dienone; 2,4-Cyclohexadien-1-One, 2,6,6-Trimethyl-
• Molecular Formula: C₉H₁₂O
• Molecular Weight: 136.19
• CAS Registry Number: 13487-30-4
• EINECS: 236-800-3
• SMILES: CC1(C(=O)C(=CC=C1)C)C
• InChI: 1S/C9H12O/c1-7-5-4-6-9(2,3)8(7)10/h4-6H,1-3H3
• InChIKey: HRIODPQRCSAJMO-UHFFFAOYSA-N

Properties

• Density: 0.933g/cm³ (Cal.)
• Boiling point: 204.773°C at 760 mmHg (Cal.)
• Flash point: 77.868°C (Cal.)