alpha-Vetivone
[CAS# 15764-04-2]

Identification

• Name: alpha-Vetivone
• Synonyms: (4R,4As)-6-Isopropylidene-4,4A-Dimethyl-4,5,7,8-Tetrahydro-3H-Naphthalen-2-One; C09744; Alpha-Vetivone
• Molecular Formula: C₁₅H₂₂O
• Molecular Weight: 218.34
• CAS Registry Number: 15764-04-2
• EINECS: 239-855-1
• SMILES: [C@]12(C(=CC(=O)C[C@H]1C)CCC(C2)=C(C)C)C
• InChI: 1S/C15H22O/c1-10(2)12-5-6-13-8-14(16)7-11(3)15(13,4)9-12/h8,11H,5-7,9H2,1-4H3/t11-,15+/m1/s1
• InChIKey: NIIPDXITZPFFTE-ABAIWWIYSA-N

Properties

• Density: 1.0±0.1g/cm³ (Cal.)
• Boiling point: 331.6±42.0°C at 760 mmHg (Cal.)
• Flash point: 147.1±18.7°C (Cal.)