3-Isopropyl-5,5-Dimethyl-2-Cyclohexen-1-One
[CAS# 28017-79-0]

Identification

• Name: 3-Isopropyl-5,5-Dimethyl-2-Cyclohexen-1-One
• Synonyms: 3-Isopropyl-5,5-dimethyl-2-cyclohexen-1-one #
• Molecular Formula: C₁₁H₁₈O
• Molecular Weight: 166.26
• CAS Registry Number: 28017-79-0
• SMILES: O=C1\C=C(/CC(C)(C)C1)C(C)C
• InChI: 1S/C11H18O/c1-8(2)9-5-10(12)7-11(3,4)6-9/h5,8H,6-7H2,1-4H3
• InChIKey: MYUGFXPFGVRZED-UHFFFAOYSA-N

Properties

• Density: 0.9g/cm³ (Cal.)
• Boiling point: 231.147°C at 760 mmHg (Cal.)
• Flash point: 94.517°C (Cal.)
• Refractive index: 1.46 (Cal.)