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Chemical Name
Cas Number
EINECS Number
MDL Number
Molecular Formula
InChIKey
Smiles
Journal Title
GO
octane
CAS 111-65-9
Molecular Formula:
C
8
H
18
Molecular Weight:
114.231 g/mol
Registry Numbers:
Cas Number:
111-65-9
EINECS Number:
203-892-1
MDL Number:
MFCD00009556
InChIKey:
TVMXDCGIABBOFY-UHFFFAOYAY
Smiles:
CCCCCCCC
Data for octane
Synthesis Reference(s) for octane:
The Journal of Organic Chemistry, 55, p. 6194, 1990
DOI:
10.1021/jo00312a029
Tetrahedron, 48, p. 8881, 1992
Tetrahedron Letters, 31, p. 5093, 1990
Synonym Chemical Name(s):
octane
111-65-9
octan
octane
オクタン
View all synonym chemical names
Physical Properties:
Melting Point:
-57 ºC
Boiling Point:
125-127 ºC
Density:
0.708 g/mL
Refractive Index:
1.3980
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