Isoamyl 2-methylbutyrate

CAS	27625-35-0
Structure
Synonyms	Butanoic acid, 2-methyl-, 3-methylbutyl ester
IUPAC Name	3-Methylbutyl 2-methylbutanoate
Molecular Weight	172.26
Canonical SMILES	CCC(C)C(=O)OCCC(C)C
InChI	InChI=1S/C10H20O2/c1-5-9(4)10(11)12-7-6-8(2)3/h8-9H,5-7H2,1-4H3
InChI Key	VGIRHYHLQKDEPP-UHFFFAOYSA-N
Boiling Point	41 °C
Flash Point	143 °F
Purity	98%+
Density	0.857 g/mL at 25 °C(lit.)
Solubility	Soluble in ethanol and oil, insoluble in water
Exact Mass	172.146329876
Monoisotopic Mass	172.146329876
Physical State	Liquid
Refractive Index	n20/D 1.413(lit.)
Topological Polar Surface Area	26.3 Ų