Allyl alpha-ionone

CAS	79-78-7
Structure
Synonyms	1-(2,6,6-Trimethyl-2-cyclohexen-1-yl)-1,6-heptadien-3-one
IUPAC Name	(1E)-1-(2,6,6-Trimethylcyclohex-2-en-1-yl)hepta-1,6-dien-3-one
Molecular Weight	232.36
Canonical SMILES	CC1=CCCC(C1C=CC(=O)CCC=C)(C)C
InChI	InChI=1S/C16H24O/c1-5-6-9-14(17)10-11-15-13(2)8-7-12-16(15,3)4/h5,8,10-11,15H,1,6-7,9,12H2,2-4H3/b11-10+
InChI Key	FXCYGAGBPZQRJE-ZHACJKMWSA-N
Boiling Point	102-104 °C
Flash Point	>230 °F
Purity	95%+
Density	0.928 g/mL at 25 °C(lit.)
Solubility	Soluble in alcohol; insoluble in water
Exact Mass	232.182715385
Isomeric SMILES	CC1=CCCC(C1/C=C/C(=O)CCC=C)(C)C
Monoisotopic Mass	232.182715385
Odor	Fruity, woody odor
Physical State	Liquid
Refractive Index	n20/D 1.505(lit.)
Topological Polar Surface Area	17.1 Ų