chempirical

Sodium trifluoroacetate

C2F3NaO2CAS 2923-18-4136.00 g/mol

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

Properties

Molecular formula
C2F3NaO2
Molar mass
136.00 g/mol
Exact mass
135.9748 Da
Density
1.91 g/mL
Melting point
207 °C (decomposes)
logP
0.25Crippen estimate
Polar surface area
37.3 Ų
H-bond donors / acceptors
1 / 1
Rotatable bonds
0

Identifiers

CAS number
2923-18-4
SMILES
[O-]C(=O)C(F)(F)F.[Na+]
InChIKey
UKXIHEBXRGRYQF-UHFFFAOYSA-N
InChI
InChI=1S/C2HF3O2.Na/c3-2(4,5)1(6)7;/h(H,6,7);

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

Names and synonyms

7 names
  • Acetic acid, 2,2,2-trifluoro-, sodium salt (1:1)
  • Acetic acid, trifluoro-, sodium salt
  • Trifluoroacetic acid, sodium salt
  • Trifluoroacetate sodium
  • Sodium perfluoroacetate
  • Sodium trifluoromethanecarboxylate
  • Sodium 2,2,2-trifluoroacetate

Work with Sodium trifluoroacetate

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

Mercuric trifluoroacetate13257-51-771 % similar Thallium(III) trifluoroacetate23586-53-071 % similar Potassium trifluoroacetate2923-16-271 % similar Lithium trifluoroacetate2923-17-371 % similar Silver trifluoroacetate2966-50-971 % similar Copper(II) trifluoroacetate hydrate123333-88-063 % similar Sodium chlorodifluoroacetate1895-39-256 % similar Sodium pentafluoropropionate378-77-856 % similar

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

Elsewhere

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