(2S,5R)-2-Acetyl-2,5-dimethylcyclohexanone
[CAS# 622367-58-2]

Identification

• Name: (2S,5R)-2-Acetyl-2,5-dimethylcyclohexanone
• Synonyms: (2S,5R)-2-acetyl-2,5-dimethylcyclohexanone
• Molecular Formula: C₁₀H₁₆O₂
• Molecular Weight: 168.23
• CAS Registry Number: 622367-58-2
• SMILES: C[C@@H]1CC[C@@](C(=O)C1)(C)C(=O)C
• InChI: 1S/C10H16O2/c1-7-4-5-10(3,8(2)11)9(12)6-7/h7H,4-6H2,1-3H3/t7-,10+/m1/s1
• InChIKey: OKXRNXXZXIZRPC-XCBNKYQSSA-N

Properties

• Density: 0.975g/cm³ (Cal.)
• Boiling point: 250.284°C at 760 mmHg (Cal.)
• Flash point: 92.007°C (Cal.)
• Refractive index: 1.449 (Cal.)