3-Methyl-5-Cyclohexadecen-1-One
[CAS# 72785-14-9]

Identification

• Name: 3-Methyl-5-Cyclohexadecen-1-One
• Synonyms: (5E)-3-Methyl-1-Cyclohexadec-5-Enone; 3-Methyl-5-Cyclohexadecen-1-One; 5-Cyclohexadecen-1-One, 3-Methyl-
• Molecular Formula: C₁₇H₃₀O
• Molecular Weight: 250.42
• CAS Registry Number: 72785-14-9
• EINECS: 276-835-1
• SMILES: CC1CC(=O)CCCCCCCCCC/C=C/C1
• InChI: 1S/C17H30O/c1-16-13-11-9-7-5-3-2-4-6-8-10-12-14-17(18)15-16/h9,11,16H,2-8,10,12-15H2,1H3/b11-9+
• InChIKey: GBCSDBVICWZSEG-PKNBQFBNSA-N

Properties

• Density: 0.853g/cm³ (Cal.)
• Boiling point: 363.72°C at 760 mmHg (Cal.)
• Flash point: 153.096°C (Cal.)