2-Methylbutanoic acid ethyl ester

CAS	7452-79-1
Structure
Synonyms	Butanoic acid, 2-methyl-, ethyl ester
IUPAC Name	Ethyl 2-methylbutyrate
Molecular Weight	130.18
Canonical SMILES	CCC(C)C(=O)OCC
InChI	InChI=1S/C7H14O2/c1-4-6(3)7(8)9-5-2/h6H,4-5H2,1-3H3
InChI Key	HCRBXQFHJMCTLF-UHFFFAOYSA-N
Boiling Point	133 °C
Melting Point	-93.23 °C
Flash Point	79 °F
Purity	99%
Density	0.865 g/mL at 25 °C(lit.)
Solubility	Soluble in alcohol, propylene glycol; very slightly soluble in water; miscible with most fixed oils
Exact Mass	130.099379685
Monoisotopic Mass	130.099379685
Physical State	Liquid
Refractive Index	n20/D 1.397(lit.)
Storage Conditions	Dry place,Room Temperature
Topological Polar Surface Area	26.3 Ų