alpha-Bisabolene

CAS	17627-44-0
Structure
Synonyms	6-Methyl-2-(4-methylcyclohex-3-enyl)hept-2,5-diene
IUPAC Name	1-Methyl-4-(6-methylhepta-2,5-dien-2-yl)cyclohexene
Molecular Weight	204.35
Canonical SMILES	CC1=CCC(CC1)C(=CCC=C(C)C)C
InChI	InChI=1S/C15H24/c1-12(2)6-5-7-14(4)15-10-8-13(3)9-11-15/h6-8,15H,5,9-11H2,1-4H3
InChI Key	YHBUQBJHSRGZNF-UHFFFAOYSA-N
Boiling Point	276.9±25.0 °C
Flash Point	>100 °C
Purity	95%
Density	0.859±0.06 g/cm³
Exact Mass	204.187800766
Monoisotopic Mass	204.187800766
Physical State	Liquid
Refractive Index	n20/D 1.493-1.500(lit.)
Topological Polar Surface Area	0 Ų