CCCCCCCC
CAS: 111-65-9
Nombre: octane
SMILES: CCCCCCCC

Molecular Processing

Molecular formula
C8H18
Molecular weight
114.23
Exact mass
114.1409
XLogP
3.37
TPSA
0
H-bond donors
0
H-bond acceptors
0
Rotatable bonds
5
Heavy atoms
8
Rings
0
Aromatic rings
0
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
0
Covalent units
1
Fraction Csp3
1
Molar refractivity
39.05

Supplementary Information

InChIKey: TVMXDCGIABBOFY-UHFFFAOYSA-N
Sinónimos
octanen-octane111-65-9OktanOktanenOttaniDTXSID0026882X1RV0B2FJVNSC-9822DTXCID406882CHEBI:17590normal-OctaneRefChem:6664203-892-1608-610-4Oktanen [Dutch]Oktan [Polish]Ottani [Italian]n-OktanMFCD00009556CH3-[CH2]6-CH3Heptane, methyl-Normal octaneOctane, all isomersOctane; NSC 9822; n-Octaneoctano9065-92-3HSDB 108NSC 9822EINECS 203-892-1
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