Sodium trifluoromethanesulfinate

CF3NaO2SCAS 2926-29-6156.05 g/mol

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O−SOFFFNa+
Alkyl halide

Properties

Molecular formula
CF3NaO2S
Molar mass
156.05 g/mol
Exact mass
155.9469 Da
logP
0.35Crippen estimate
Polar surface area
37.3 Ų
H-bond donors / acceptors
1 / 1
Rotatable bonds
0

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
2926-29-6
SMILES
[O-]S(=O)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

5 names
  • Methanesulfinic acid, 1,1,1-trifluoro-, sodium salt (1:1)
  • Methanesulfinic acid, trifluoro-, sodium salt
  • Sodium trifluoromethylsulfinate
  • Sodium triflinate
  • Langlois reagent

Work with Sodium trifluoromethanesulfinate

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.

Potassium trifluoromethanesulfinate41804-89-1Salt

Similar compounds

Sodium sulfite7757-83-736 % similar Sodium dithionite7775-14-636 % similar Sodium sulfite heptahydrate10102-15-532 % similar Sodium methanesulfinate20277-69-432 % similar Sodium bisulfite7631-90-532 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Elsewhere

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