chempirical

2,2,3,3,4,4,5,5-Octafluorohexanedinitrile

C6F8N2CAS 376-53-4252.07 g/mol

Open in Covalent MOL file
NFFFFFFFFN
Alkyl halideNitrile

Properties

Molecular formula
C6F8N2
Molar mass
252.07 g/mol
Exact mass
251.9934 Da
Boiling point
63 °C
logP
2.57Crippen estimate
Polar surface area
47.6 Ų
H-bond donors / acceptors
0 / 2
Rotatable bonds
3

Identifiers

CAS number
376-53-4
SMILES
N#CC(F)(F)C(F)(F)C(F)(F)C(F)(F)C#N
InChIKey
PZIVXXORSILYOQ-UHFFFAOYSA-N
InChI
InChI=1S/C6F8N2/c7-3(8,1-15)5(11,12)6(13,14)4(9,10)2-16

Weigh it out

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

Names and synonyms

5 names
  • Hexanedinitrile, 2,2,3,3,4,4,5,5-octafluoro-
  • Hexanedinitrile, octafluoro-
  • Perfluoroadiponitrile
  • Perfluoroadipic acid dinitrile
  • Octafluoroadiponitrile

Work with 2,2,3,3,4,4,5,5-Octafluorohexanedinitrile

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

2,2,3,3,4,4,4-Heptafluorobutanenitrile375-00-874 % similar Trifluoroacetonitrile353-85-542 % similar Octafluorocyclobutane115-25-331 % similar Perfluorocyclohexane355-68-031 % similar

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

Elsewhere

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