2-Methylbutyl isovalerate

Catalog	ACM2445774
CAS	2445-77-4
Structure
Synonyms	2-Methylbutyl isopentanoate
IUPAC Name	2-Methylbutyl 3-methylbutanoate
Molecular Weight	172.26
Molecular Formula	C10H20O2
Canonical SMILES	CCC(C)COC(=O)CC(C)C
InChI	InChI=1S/C10H20O2/c1-5-9(4)7-12-10(11)6-8(2)3/h8-9H,5-7H2,1-4H3
InChI Key	CYGPPWVXOWCHJB-UHFFFAOYSA-N
Boiling Point	191-195 °C
Melting Point	-68.47 °C
Flash Point	143 °F
Purity	98%+
Density	0.858 g/mL at 25 °C(lit.)
Exact Mass	172.146329876
Monoisotopic Mass	172.146329876
Physical State	Liquid
Refractive Index	n20/D 1.414(lit.)
Topological Polar Surface Area	26.3 Ų