CAS Registry Number®
110-19-0
CAS Name
Isobutyl acetate
Molecular Formula
C6H12O2
Molecular Mass
116.16
Compound Properties
-
Boiling Point (1)
116.5 °C
-
Melting Point (1)
-98.8 °C
-
Density (1)
0.8712 g/cm³ @ Temp: 20 °C
Source(s)
- (1) Hazardous Substances Data Bank data were obtained from the National Library of Medicine (US)
Other Names and Identifiers
InChI
InChI=1S/C6H12O2/c1-5(2)4-8-6(3)7/h5H,4H2,1-3H3
InChIKey
InChIKey=GJRQTCIYDGXPES-UHFFFAOYSA-N
SMILES
C(OC(C)=O)C(C)C
Canonical SMILES
O=C(OCC(C)C)C
Other Names for this Substance
- Acetic acid, 2-methylpropyl ester
- Acetic acid, isobutyl ester
- Isobutyl acetate
- β-Methylpropyl ethanoate
- 2-Methylpropyl acetate
- NSC 8035
