3,5-Dimethyl-4-(3-Methyl-2-Butenyl)Cyclohexanone
[CAS# 71820-44-5]

Identification

• Name: 3,5-Dimethyl-4-(3-Methyl-2-Butenyl)Cyclohexanone
• Synonyms: (3S,5S)-3,5-Dimethyl-4-(3-Methylbut-2-Enyl)-1-Cyclohexanone; 3,5-Dimethyl-4-(3-Methyl-2-Butenyl)Cyclohexanone; Cyclohexanone, 3,5-Dimethyl-4-(3-Methyl-2-Butenyl)-
• Molecular Formula: C₁₃H₂₂O
• Molecular Weight: 194.32
• CAS Registry Number: 71820-44-5
• SMILES: [C@@H]1(CC(=O)C[C@@H]([C@H]1CC=C(C)C)C)C
• InChI: 1S/C13H22O/c1-9(2)5-6-13-10(3)7-12(14)8-11(13)4/h5,10-11,13H,6-8H2,1-4H3/t10-,11-/m0/s1
• InChIKey: WRDVCBWZNKZSNG-QWRGUYRKSA-N

Properties

• Density: 0.87g/cm³ (Cal.)
• Boiling point: 267.579°C at 760 mmHg (Cal.)
• Flash point: 105.589°C (Cal.)