(4R,5S)-4-Isopropyl-5-Methyl-2-Cyclohexen-1-One
[CAS# 102245-21-6]

Identification

• Name: (4R,5S)-4-Isopropyl-5-Methyl-2-Cyclohexen-1-One
• Synonyms: (4R,5S)-4-isopropyl-5-methylcyclohex-2-enone
• Molecular Formula: C₁₀H₁₆O
• Molecular Weight: 152.23
• CAS Registry Number: 102245-21-6
• SMILES: C[C@H]1CC(=O)C=C[C@@H]1C(C)C
• InChI: 1S/C10H16O/c1-7(2)10-5-4-9(11)6-8(10)3/h4-5,7-8,10H,6H2,1-3H3/t8-,10+/m0/s1
• InChIKey: XQTVBJNIDHXCNX-WCBMZHEXSA-N

Properties

• Density: 0.904g/cm³ (Cal.)
• Boiling point: 220.274°C at 760 mmHg (Cal.)
• Flash point: 92.929°C (Cal.)
• Refractive index: 1.458 (Cal.)