(4R,5S)-4-Hydroxy-2-Isopropyl-5-Methyl-2-Cyclohexen-1-One
[CAS# 170127-86-3]

Identification

• Name: (4R,5S)-4-Hydroxy-2-Isopropyl-5-Methyl-2-Cyclohexen-1-One
• Synonyms: (4R,5S)-4-hydroxy-2-isopropyl-5-methylcyclohex-2-enone
• Molecular Formula: C₁₀H₁₆O₂
• Molecular Weight: 168.23
• CAS Registry Number: 170127-86-3
• SMILES: C[C@H]1CC(=O)C(=C[C@@H]1O)C(C)C
• InChI: 1S/C10H16O2/c1-6(2)8-5-9(11)7(3)4-10(8)12/h5-7,9,11H,4H2,1-3H3/t7-,9-/m0/s1
• InChIKey: KQOMIFMCYIYIGJ-CBAPKCEASA-N

Properties

• Density: 1.03g/cm³ (Cal.)
• Boiling point: 283.028°C at 760 mmHg (Cal.)
• Flash point: 118.671°C (Cal.)
• Refractive index: 1.494 (Cal.)