Chemical Compound

Sodium 3-cyanobenzenesulfinate

CAS Registry Number1000308-30-4
Sodium 3-cyanobenzenesulfinate chemical structure
Primary record

Sodium 3-cyanobenzenesulfinate

CAS
1000308-30-4
PubChem CID
58258873
SMILES
C1=CC(=CC(=C1)S(=O)[O-])C#N.[Na+]
Molecular Formula
C7H4NNaO2S
Molecular Weight
189.171
Exact Mass
188.986
InChI
InChI=1S/C7H5NO2S.Na/c8-5-6-2-1-3-7(4-6)11(9)10;/h1-4H,(H,9,10);/q;+1/p-1
InChIKey
ATMVDUXXBTXSPZ-UHFFFAOYSA-M
LogP
-2.1997
TPSA
63.92

Names and synonyms

  • Sodium 3-cyanobenzenesulfinate
  • sodium;3-cyanobenzenesulfinate
  • C7H4NNaO2S
  • Sodium3-cyanobenzenesulfinate
  • SCHEMBL315851
  • MFCD29127295
  • sodium 3-cyanobenzene-1-sulfinate
  • Sodium 3-cyano-benzenesulfinate
  • ATMVDUXXBTXSPZ-UHFFFAOYSA-M
  • 1000308-30-4
  • SY378505
  • EN300-722540
  • G68585