2,6-Dimethyl-4-(3-Methylbutyl)Cyclohexanone
[CAS# 71820-43-4]

Identification

• Name: 2,6-Dimethyl-4-(3-Methylbutyl)Cyclohexanone
• Synonyms: (2R,6R)-4-Isopentyl-2,6-Dimethyl-Cyclohexan-1-One; (2R,6R)-4-Isopentyl-2,6-Dimethyl-1-Cyclohexanone; (2R,6R)-4-Isoamyl-2,6-Dimethyl-Cyclohexan-1-One
• Molecular Formula: C₁₃H₂₄O
• Molecular Weight: 196.33
• CAS Registry Number: 71820-43-4
• SMILES: [C@@H]1(C(=O)[C@@H](C[C@@H](C1)CCC(C)C)C)C
• InChI: 1S/C13H24O/c1-9(2)5-6-12-7-10(3)13(14)11(4)8-12/h9-12H,5-8H2,1-4H3/t10-,11-/m1/s1
• InChIKey: NAQRGRASVQCNKC-GHMZBOCLSA-N

Properties

• Density: 0.852g/cm³ (Cal.)
• Boiling point: 253.053°C at 760 mmHg (Cal.)
• Flash point: 99.491°C (Cal.)