Butanoic acid, 2-methylbutyl ester

CAS	51115-64-1
Structure
IUPAC Name	2-Methylbutyl butyrate
Molecular Weight	158.24
Canonical SMILES	CCCC(=O)OCC(C)CC
InChI	InChI=1S/C9H18O2/c1-4-6-9(10)11-7-8(3)5-2/h8H,4-7H2,1-3H3
InChI Key	MBZKQDXXFMITAC-UHFFFAOYSA-N
Boiling Point	183.34 °C
Melting Point	-73 °C
Purity	99%
Density	0.8809 g/mL at 25 °C(lit.)
Exact Mass	158.130679813
Monoisotopic Mass	158.130679813
Refractive Index	n20/D 1.3864(lit.)
Topological Polar Surface Area	26.3 Ų