Phenethyl isovalerate

CAS	140-26-1
Synonyms	Butanoic acid, 3-methyl-, 2-phenylethyl ester
IUPAC Name	2-Phenylethyl 3-methylbutanoate
Molecular Weight	206.28
Canonical SMILES	CC(C)CC(=O)OCCC1=CC=CC=C1
InChI	InChI=1S/C13H18O2/c1-11(2)10-13(14)15-9-8-12-6-4-3-5-7-12/h3-7,11H,8-10H2,1-2H3
InChI Key	JIMGVOCOYZFDKB-UHFFFAOYSA-N
Boiling Point	268 °C
Flash Point	>230 °F
Purity	98%+
Density	0.974 g/mL at 25 °C(lit.)
Solubility	Insoluble in water; soluble in oils
Exact Mass	206.130679813
Monoisotopic Mass	206.130679813
Physical State	Liquid
Refractive Index	n20/D 1.485(lit.)
Storage Conditions	Dry place,Room Temperature
Topological Polar Surface Area	26.3 Ų