2,6,6-Trimethyl-1-cyclohexene-1-acetaldehyde

CAS	472-66-2
Structure
Synonyms	β-Homocyclocitral
IUPAC Name	2-(2,6,6-Trimethylcyclohexen-1-yl)acetaldehyde
Molecular Weight	166.26
Canonical SMILES	CC1=C(C(CCC1)(C)C)CC=O
InChI	InChI=1S/C11H18O/c1-9-5-4-7-11(2,3)10(9)6-8-12/h8H,4-7H2,1-3H3
InChI Key	VHTFHZGAMYUZEP-UHFFFAOYSA-N
Boiling Point	58-59 °C
Flash Point	191 °F
Purity	95%+
Density	0.941 g/mL at 25 °C(lit.)
Solubility	Insoluble in water, soluble in fats
Exact Mass	166.135765193
Monoisotopic Mass	166.135765193
Odor	Herbaceous aroma
Physical State	Liquid
Refractive Index	n20/D 1.485(lit.)
Storage Conditions	2-8 °C
Topological Polar Surface Area	17.1 Ų