Sodium pentafluoropropionate

C3F5NaO2CAS 378-77-8186.01 g/mol

Open in Covalent MOL file
O−OFFFFFNa+
Alkyl halideCarboxylic acid

Properties

Molecular formula
C3F5NaO2
Molar mass
186.01 g/mol
Exact mass
185.9716 Da
logP
0.89Crippen estimate
Polar surface area
37.3 Ų
H-bond donors / acceptors
1 / 1
Rotatable bonds
1

Hazards

No GHS classification is on file for this compound. That is not evidence that it is harmless.

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Identifiers

CAS number
378-77-8
SMILES
[O-]C(=O)C(F)(F)C(F)(F)F.[Na+]
InChI

The InChI we hold for this record describes the parent acid and the metal separately rather than the salt above, so it is not shown here.

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Names and synonyms

8 names
  • Propanoic acid, 2,2,3,3,3-pentafluoro-, sodium salt (1:1)
  • Propionic acid, pentafluoro-, sodium salt
  • Propanoic acid, pentafluoro-, sodium salt
  • Sodium perfluoropropionate
  • Sodium pentafluoropropanoate
  • Sodium perfluoropropanoate
  • 2,2,3,3,3-Pentafluoropropanoic acid sodium salt
  • Pentafluoropropionic acid sodium salt

Work with Sodium pentafluoropropionate

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

Stereoisomers, salts and isotopologues

The same compound in another form: other stereochemistry, a salt or hydrate, the free acid or base, or an isotope-labelled version.

Perfluoropropionic acid422-64-0Free acid

Similar compounds

Sodium heptafluorobutyrate2218-54-473 % similar Perfluorooctanoic acid sodium salt335-95-568 % similar Sodium trifluoroacetate2923-18-456 % similar Silver heptafluorobutyrate3794-64-755 % similar Sodium chlorodifluoroacetate1895-39-250 % similar Mercuric trifluoroacetate13257-51-744 % similar Sodium trichloroacetate650-51-144 % similar Dalapon sodium127-20-840 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Elsewhere

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