1-(3,7,7-Trimethylbicyclo[4.1.0]Hept-3-En-2-Yl)Ethan-1-One
[CAS# 40824-36-0]

Identification

• Name: 1-(3,7,7-Trimethylbicyclo[4.1.0]Hept-3-En-2-Yl)Ethan-1-One
• Synonyms: 3-Carene, 2-Acetyl-; 1-(3,7,7-Trimethylbicyclo(4.1.0)Hept-3-En-2-Yl)Ethan-1-One
• Molecular Formula: C₁₂H₁₈O
• Molecular Weight: 178.27
• CAS Registry Number: 40824-36-0
• EINECS: 255-095-3
• SMILES: CC1(C2C1CC=C(C2C(=O)C)C)C
• InChI: 1S/C12H18O/c1-7-5-6-9-11(12(9,3)4)10(7)8(2)13/h5,9-11H,6H2,1-4H3
• InChIKey: XCBVDXSSPNIVAO-UHFFFAOYSA-N

Properties

• Density: 0.958g/cm³ (Cal.)
• Boiling point: 236.225°C at 760 mmHg (Cal.)
• Flash point: 89.707°C (Cal.)