Isopentyl isobutyrate

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Catalog Number ACM2050013-1
Product Name Isopentyl isobutyrate
CAS Number 2050-01-3
Structure Isopentyl isobutyrate
IUPAC Name 3-Methylbutyl 2-methylpropanoate
Synonyms Propanoic acid, 2-methyl-, 3-methylbutyl ester
Molecular Weight 158.24
Molecular Formula C9H18O2
Canonical SMILES CC(C)CCOC(=O)C(C)C
Inchi InChI=1S/C9H18O2/c1-7(2)5-6-11-9(10)8(3)4/h7-8H,5-6H2,1-4H3
InChIKey VFTGLSWXJMRZNB-UHFFFAOYSA-N
Boiling Point 169-171 °C
Melting Point -73 °C
Flash Point 129 °F
Purity 98%+
Density 0.856 g/mL at 25 °C(lit.)
Physical State Liquid
Refractive Index n20/D 1.406(lit.)

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