Cyclohexanecarboxylic acid, 2,2-dimethyl-6-methylene-, methyl ester

CAS	81752-87-6
Structure
Synonyms	Damascone carboxylate
IUPAC Name	Methyl 2,2-dimethyl-6-methylidenecyclohexane-1-carboxylate
Molecular Weight	182.26
Canonical SMILES	CC1(CCCC(=C)C1C(=O)OC)C
InChI	InChI=1S/C11H18O2/c1-8-6-5-7-11(2,3)9(8)10(12)13-4/h9H,1,5-7H2,2-4H3
InChI Key	SMJXJPQSPQXVMU-UHFFFAOYSA-N
Boiling Point	215.6±29.0 °C
Flash Point	74 °C
Purity	95%+
Density	0.95±0.1 g/cm³
Exact Mass	182.130679813
Monoisotopic Mass	182.130679813
Physical State	Liquid
Refractive Index	n20/D 1.461-1.465(lit.)
Topological Polar Surface Area	26.3 Ų