3-Acetyl-4,4-Dimethyl-2,5-Cyclohexadien-1-One
[CAS# 127701-69-3]

Identification

• Name: 3-Acetyl-4,4-Dimethyl-2,5-Cyclohexadien-1-One
• Synonyms: 3-acetyl-4,4-dimethylcyclohexa-2,5-dienone
• Molecular Formula: C₁₀H₁₂O₂
• Molecular Weight: 164.20
• CAS Registry Number: 127701-69-3
• SMILES: CC(=O)C1=CC(=O)C=CC1(C)C
• InChI: 1S/C10H12O2/c1-7(11)9-6-8(12)4-5-10(9,2)3/h4-6H,1-3H3
• InChIKey: YSEJRIMNHOPGFQ-UHFFFAOYSA-N

Properties

• Density: 1.045g/cm³ (Cal.)
• Boiling point: 273.545°C at 760 mmHg (Cal.)
• Flash point: 101.49°C (Cal.)
• Refractive index: 1.491 (Cal.)