chempirical

Sodium methanesulfinate

CH3NaO2SCAS 20277-69-4102.08 g/mol

Open in Covalent MOL file
SO−ONa+

Properties

Molecular formula
CH3NaO2S
Molar mass
102.08 g/mol
Exact mass
101.9751 Da
logP
-0.54Crippen estimate
Polar surface area
37.3 Ų
H-bond donors / acceptors
1 / 1
Rotatable bonds
0

Identifiers

CAS number
20277-69-4
SMILES
CS([O-])=O.[Na+]
InChIKey
RHDUOFVTCTUTFX-UHFFFAOYSA-N
InChI
InChI=1S/CH4O2S.Na/c1-4(2)3;/h1H3,(H,2,3);

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Names and synonyms

3 names
  • Methanesulfinic acid, sodium salt (1:1)
  • Methanesulfinic acid, sodium salt
  • Sodium methylsulfinate

Work with Sodium methanesulfinate

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

Sodium sulfite7757-83-742 % similar Sodium dithionite7775-14-642 % similar Sodium sulfite heptahydrate10102-15-536 % similar Sodium bisulfite7631-90-536 % similar Rongalite149-44-032 % similar Sodium trifluoromethanesulfinate2926-29-632 % similar Sodium metabisulfite7681-57-431 % similar Sodium diacetate126-96-530 % similar

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

Elsewhere

PubChem CAS Common Chemistry NIST WebBook