CAS Registry Number®
4643-27-0
CAS Name
2-Octen-4-one
Molecular Formula
C8H14O
Molecular Mass
126.20
Compound Properties
-
Boiling Point (1)
178 °C
-
Density (1)
0.852 g/cm³ @ Temp: 20 °C
Source(s)
- (1) Stutsman, Paul S.; Journal of the American Chemical Society, (1939), 61, 3303-6, CAplus
Other Names and Identifiers
InChI
InChI=1S/C8H14O/c1-3-5-7-8(9)6-4-2/h4,6H,3,5,7H2,1-2H3
InChIKey
InChIKey=FMDLEUPBHMCPQV-UHFFFAOYSA-N
SMILES
C(CCCC)(C=CC)=O
Canonical SMILES
O=C(C=CC)CCCC
Other Names for this Substance
- 2-Octen-4-one
- Butyl 1-propenyl ketone