4-(2,6,6-Trimethyl-1,3-Cyclohexadien-1-Yl)Butan-2-One
[CAS# 20483-36-7]

Identification

• Name: 4-(2,6,6-Trimethyl-1,3-Cyclohexadien-1-Yl)Butan-2-One
• Synonyms: 2-Butanone, 4-(2,6,6-Trimethyl-1,3-Cyclohexadien-1-Yl)-; 4-(2,6,6-Trimethyl-1,3-Cyclohexadien-1-Yl)-2-Butanone; 4-(2,6,6-Trimethyl-1,3-Cyclohexadien-1-Yl)Butan-2-One
• Molecular Formula: C₁₃H₂₀O
• Molecular Weight: 192.30
• CAS Registry Number: 20483-36-7
• EINECS: 243-847-3
• FEMA: 3447
• SMILES: C(C1=C(C=CCC1(C)C)C)CC(=O)C
• InChI: 1S/C13H20O/c1-10-6-5-9-13(3,4)12(10)8-7-11(2)14/h5-6H,7-9H2,1-4H3
• InChIKey: SQFRYZPEWOZAKJ-UHFFFAOYSA-N

Properties

• Density: 0.894g/cm³ (Cal.)
• Boiling point: 267.425°C at 760 mmHg (Cal.)
• Flash point: 95.565°C (Cal.)