3-Isopropyl-6-Methyl-2-Cyclohepten-1-One
[CAS# 205177-22-6]

Identification

• Name: 3-Isopropyl-6-Methyl-2-Cyclohepten-1-One
• Synonyms: 3-isopropyl-6-methylcyclohept-2-enone
• Molecular Formula: C₁₁H₁₈O
• Molecular Weight: 166.26
• CAS Registry Number: 205177-22-6
• SMILES: CC1CCC(=CC(=O)C1)C(C)C
• InChI: 1S/C11H18O/c1-8(2)10-5-4-9(3)6-11(12)7-10/h7-9H,4-6H2,1-3H3
• InChIKey: QKUDYLNAEFCJFS-UHFFFAOYSA-N

Properties

• Density: 0.903g/cm³ (Cal.)
• Boiling point: 245.82°C at 760 mmHg (Cal.)
• Flash point: 102.396°C (Cal.)
• Refractive index: 1.462 (Cal.)