chempirical

Heptafluorobutyramide

C4H2F7NOCAS 662-50-0213.05 g/mol

Open in Covalent MOL file
NH2OFFFFFFF
Alkyl halide

Properties

Molecular formula
C4H2F7NO
Molar mass
213.05 g/mol
Exact mass
213.0025 Da
Melting point
103 °C
logP
2.35Crippen estimate
Polar surface area
44.1 Ų
H-bond donors / acceptors
2 / 1
Rotatable bonds
2

Identifiers

CAS number
662-50-0
SMILES
N=C(O)C(F)(F)C(F)(F)C(F)(F)F
InChIKey
FOBJABJCODOMEO-UHFFFAOYSA-N
InChI
InChI=1S/C4H2F7NO/c5-2(6,1(12)13)3(7,8)4(9,10)11/h(H2,12,13)

Weigh it out

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

Names and synonyms

7 names
  • Butanamide, 2,2,3,3,4,4,4-heptafluoro-
  • Butyramide, 2,2,3,3,4,4,4-heptafluoro-
  • 2,2,3,3,4,4,4-Heptafluorobutanamide
  • Perfluorobutyramide
  • Heptafluorobutanoic acid amide
  • NSC 9451
  • Heptafluorobutanamide

Work with Heptafluorobutyramide

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 Isotope patternExact mass and the mass spectrum pattern

Similar compounds

2,2,3,3,4,4,5,5,6,6,7,7,8,8,8-Pentadecafluorooctanamide423-54-183 % similar 2,2,3,3,3-Pentafluoropropanamide354-76-770 % similar 2,2,3,3-Tetrafluorobutanediamide377-37-764 % similar Perfluorobutanoic acid375-22-450 % similar Trifluoroacetamide354-38-144 % similar Perfluoropentanoic acid2706-90-343 % similar Perfluorooctadecanoic acid16517-11-642 % similar Perfluorohexanoic acid307-24-442 % similar

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

Elsewhere

PubChem CAS Common Chemistry NIST WebBook