Pentyl isobutyrate

CAS	2445-72-9
Structure
Synonyms	Amyl isobutyrate
IUPAC Name	Pentyl 2-methylpropanoate
Molecular Weight	158.24
Canonical SMILES	CCCCCOC(=O)C(C)C
InChI	InChI=1S/C9H18O2/c1-4-5-6-7-11-9(10)8(2)3/h8H,4-7H2,1-3H3
InChI Key	UYGGIIOLYXRSQY-UHFFFAOYSA-N
Boiling Point	183.34 °C
Melting Point	-73 °C
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