Butanoic acid, 1-methyl-1-(4-methyl-3-cyclohexen-1-yl)ethyl ester

CAS	2153-28-8
Structure
Synonyms	Terpinyl butyrate
IUPAC Name	2-(4-Methylcyclohex-3-en-1-yl)propan-2-yl butanoate
Molecular Weight	224.34
Canonical SMILES	CCCC(=O)OC(C)(C)C1CCC(=CC1)C
InChI	InChI=1S/C14H24O2/c1-5-6-13(15)16-14(3,4)12-9-7-11(2)8-10-12/h7,12H,5-6,8-10H2,1-4H3
InChI Key	LWKWNIYBQLKBMQ-UHFFFAOYSA-N
Boiling Point	244 °C
Flash Point	>230 °F
Purity	95%+
Density	0.938 g/mL at 25 °C(lit.)
Solubility	Insoluble in water; soluble in alcohols and oils
Exact Mass	224.177630004
Monoisotopic Mass	224.177630004
Physical State	Liquid
Refractive Index	n20/D 1.4650(lit.)
Topological Polar Surface Area	26.3 Ų