Cas no 54995-24-3 (4,5-dimercapto-1,3-dithiole-2-thione, sodium salt)

4,5-dimercapto-1,3-dithiole-2-thione, sodium salt structure
54995-24-3 structure
Product Name:4,5-dimercapto-1,3-dithiole-2-thione, sodium salt
CAS No:54995-24-3
MF:C3Na2S5
MW:242.3366355896
CID:3048348
PubChem ID:13863265
Update Time:2025-04-21

4,5-dimercapto-1,3-dithiole-2-thione, sodium salt Chemical and Physical Properties

Names and Identifiers

    • 4,5-dimercapto-1,3-dithiole-2-thione, sodium salt
    • 2-thioxo-1,3-dithiole-4,5-dithiolato sodium;2-thioxo-1,3-dithiole-4,5-dithiol disodium salt;sodium 1,3-dithiole-2-thione-4,5-dithiolate;disodium 1,3-dithiole-2-thione-4,5-dithiolate;disodium 1,3-dithiol-2-thione-4,5-dithiolate;disodium 4,5-dimercapto-1,3-dithiole-2-thionate;
    • 54995-24-3
    • SCHEMBL9185875
    • 4,5-Dimercapto-1,3-dithiole-2-thione sodium salt (1:2)
    • DTXSID001336298
    • Inchi: 1S/C3H2S5.2Na/c4-1-2(5)8-3(6)7-1;;/h4-5H;;/q;2*+1/p-2
    • InChI Key: GWQKWWNXXIROOM-UHFFFAOYSA-L
    • SMILES: S1C(=S)SC(=C1[S-])[S-].[Na+].[Na+]

Computed Properties

  • Exact Mass: 218.85000
  • Monoisotopic Mass: 241.83989443Da
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 5
  • Heavy Atom Count: 10
  • Rotatable Bond Count: 0
  • Complexity: 141
  • Covalently-Bonded Unit Count: 3
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • Topological Polar Surface Area: 84.7?2

Experimental Properties

  • PSA: 88.57000
  • LogP: 2.35070
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