CAS Registry Number®
111-65-9
CAS Name
Octane
Molecular Formula
C8H18
Molecular Mass
114.23
Compound Properties
-
Boiling Point (1)
125.67 °C @ Press: 760 Torr
-
Melting Point (1)
-56.76 °C
-
Density (1)
0.69862 g/cm³ @ Temp: 25 °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/C8H18/c1-3-5-7-8-6-4-2/h3-8H2,1-2H3
InChIKey
InChIKey=TVMXDCGIABBOFY-UHFFFAOYSA-N
SMILES
C(CCCC)CCC
Canonical SMILES
CCCCCCCC
Other Names for this Substance
- Octane
- n-Octane
- NSC 9822
Deleted or Replaced CAS Registry Numbers
31372-91-5
