(1S,2R,5S)-2-Isopropyl-5-methylcyclohexanecarbaldehyde
[CAS# 796865-68-4]

Identification

• Name: (1S,2R,5S)-2-Isopropyl-5-methylcyclohexanecarbaldehyde
• Synonyms: (1S,2R,5S)-2-isopropyl-5-methylcyclohexanecarbaldehyde
• Molecular Formula: C₁₁H₂₀O
• Molecular Weight: 168.28
• CAS Registry Number: 796865-68-4
• SMILES: C[C@H]1CC[C@@H]([C@H](C1)C=O)C(C)C
• InChI: 1S/C11H20O/c1-8(2)11-5-4-9(3)6-10(11)7-12/h7-11H,4-6H2,1-3H3/t9-,10+,11+/m0/s1
• InChIKey: AUABNXZOGNPUSY-HBNTYKKESA-N

Properties

• Density: 0.909g/cm³ (Cal.)
• Boiling point: 222.614°C at 760 mmHg (Cal.)
• Flash point: 75.223°C (Cal.)
• Refractive index: 1.483 (Cal.)