3-Cyclohexene-1-carboxylic acid, 6,6-dimethyl-2-methylene-, ethyl ester

CAS	35044-58-7
Structure
Synonyms	Ethyl safranate
IUPAC Name	Ethyl 6,6-dimethyl-2-methylidenecyclohex-3-ene-1-carboxylate
Molecular Weight	194.27
Canonical SMILES	CCOC(=O)C1C(=C)C=CCC1(C)C
InChI	InChI=1S/C12H18O2/c1-5-14-11(13)10-9(2)7-6-8-12(10,3)4/h6-7,10H,2,5,8H2,1,3-4H3
InChI Key	DOVGPJULTGXWJT-UHFFFAOYSA-N
Boiling Point	239.1±29.0 °C
Purity	95%+
Density	0.96±0.1 g/cm³
Exact Mass	194.130679813
Monoisotopic Mass	194.130679813
Topological Polar Surface Area	26.3 Ų