2-Methylbutyl caproate

CAS	2601-13-0
Structure
Synonyms	Hexanoic acid, 2-methylbutyl ester
IUPAC Name	2-Methylbutyl hexanoate
Molecular Weight	186.29
Canonical SMILES	CCCCCC(=O)OCC(C)CC
InChI	InChI=1S/C11H22O2/c1-4-6-7-8-11(12)13-9-10(3)5-2/h10H,4-9H2,1-3H3
InChI Key	ZWMQVDONBUJJLL-UHFFFAOYSA-N
Boiling Point	214.2±8.0 °C
Purity	98%+
Density	0.870±0.06 g/cm³
Exact Mass	186.16197994
Monoisotopic Mass	186.16197994
Topological Polar Surface Area	26.3 Ų