chempirical

Octadecanenitrile

C18H35NCAS 638-65-3265.48 g/mol

Open in Covalent MOL file
N
Nitrile

Properties

Molecular formula
C18H35N
Molar mass
265.48 g/mol
Exact mass
265.2770 Da
Density
0.8325 g/mL (at 20 °C)
Melting point
41 °C
Boiling point
362 °C
logP
6.77Crippen estimate
Polar surface area
23.8 Ų
H-bond donors / acceptors
0 / 1
Rotatable bonds
15

Identifiers

CAS number
638-65-3
SMILES
CCCCCCCCCCCCCCCCCC#N
InChIKey
RHSBIGNQEIPSCT-UHFFFAOYSA-N
InChI
InChI=1S/C18H35N/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19/h2-17H2,1H3

Weigh it out

Type any one amount. The others follow from the molar mass and density.

Names and synonyms

7 names
  • Stearonitrile
  • Octadecanonitrile
  • Heptadecyl cyanide
  • Stearic nitrile
  • n-Octadecanonitrile
  • 1-Cyanoheptadecane
  • NSC 5541

Work with Octadecanenitrile

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Boiling point under vacuumAt any pressure, from its normal boiling point Isotope patternExact mass and the mass spectrum pattern

Similar compounds

Octanenitrile124-12-9100 % similar Decanenitrile1975-78-6100 % similar Nonanenitrile2243-27-8100 % similar Undecanenitrile2244-07-7100 % similar Dodecanenitrile2437-25-4100 % similar Heptanenitrile629-08-3100 % similar Tridecanenitrile629-60-7100 % similar Hexanenitrile628-73-994 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Elsewhere

PubChem CAS Common Chemistry NIST WebBook