Vernaldehyde

Catalog	ACM66327546
CAS	66327-54-6
Structure
Synonyms	1-Formyl-1-methyl-4-(4-methylpentyl)-3-cyclohexene
IUPAC Name	1-Methyl-4-(4-methylpentyl)cyclohex-3-ene-1-carbaldehyde
Molecular Weight	208.34
Molecular Formula	C14H24O
Canonical SMILES	CC(C)CCCC1=CCC(CC1)(C)C=O
InChI	InChI=1S/C14H24O/c1-12(2)5-4-6-13-7-9-14(3,11-15)10-8-13/h7,11-12H,4-6,8-10H2,1-3H3
InChI Key	MVTYXAVPKZRAMW-UHFFFAOYSA-N
Boiling Point	287.55 °C
Flash Point	78 °C
Purity	95%+
Density	0.9275 g/mL at 25 °C(lit.)
Exact Mass	208.182715385
Monoisotopic Mass	208.182715385
Physical State	Liquid
Refractive Index	n20/D 1.4765(lit.)
Topological Polar Surface Area	17.1 Ų