Hexyl isovalerate

CAS	10032-13-0 / 10632-13-0
Structure
Synonyms	Butanoic acid, 3-methyl-, hexyl ester
IUPAC Name	Hexyl 3-methylbutanoate
Molecular Weight	186.29
Canonical SMILES	CCCCCCOC(=O)CC(C)C
InChI	InChI=1S/C11H22O2/c1-4-5-6-7-8-13-11(12)9-10(2)3/h10H,4-9H2,1-3H3
InChI Key	RSDDTPVXLMVLQE-UHFFFAOYSA-N
Boiling Point	215 °C
Melting Point	-63.1 °C
Flash Point	190 °F
Purity	98%+
Density	0.857 g/mL at 25 °C(lit.)
Solubility	Soluble in alcohol, most fixed oils; insoluble in water
Exact Mass	186.16197994
Monoisotopic Mass	186.16197994
Odor	Fruity odor
Physical State	Liquid
Refractive Index	n20/D 1.419(lit.)
Topological Polar Surface Area	26.3 Ų