6-Methyl-3,5-heptadien-2-one

CAS	1604-28-0
Structure
Synonyms	2-Methyl-2,4-heptadien-6-one
IUPAC Name	(3E)-6-Methylhepta-3,5-dien-2-one
Molecular Weight	124.18
Canonical SMILES	CC(=CC=CC(=O)C)C
InChI	InChI=1S/C8H12O/c1-7(2)5-4-6-8(3)9/h4-6H,1-3H3/b6-4+
InChI Key	KSKXSFZGARKWOW-GQCTYLIASA-N
Boiling Point	95-96 °C
Purity	98%+
Density	0,89 g/cm³
Solubility	Miscible with alcohol; immiscible with water
Exact Mass	124.088815002
Isomeric SMILES	CC(=C/C=C/C(=O)C)C
Monoisotopic Mass	124.088815002
Odor	Cinnamon-like odor
Physical State	Oily liquid
Refractive Index	n20/D 1.5340(lit.)
Topological Polar Surface Area	17.1 Ų