Cas no 59065-21-3 (4,5-BIS(ETHYLTHIO)-1,3-DITHIOLE-2-THIONE)

4,5-BIS(ETHYLTHIO)-1,3-DITHIOLE-2-THIONE structure
59065-21-3 structure
Product Name:4,5-BIS(ETHYLTHIO)-1,3-DITHIOLE-2-THIONE
CAS No:59065-21-3
MF:C7H10S5
MW:254.479295253754
CID:949629
PubChem ID:11954576
Update Time:2025-04-19

4,5-BIS(ETHYLTHIO)-1,3-DITHIOLE-2-THIONE Chemical and Physical Properties

Names and Identifiers

    • 4,5-BIS(ETHYLTHIO)-1,3-DITHIOLE-2-THIONE
    • 4,5-bis(ethylsulfanyl)-1,3-dithiole-2-thione
    • DTXSID50474651
    • DB-315971
    • 59065-21-3
    • Inchi: 1S/C7H10S5/c1-3-9-5-6(10-4-2)12-7(8)11-5/h3-4H2,1-2H3
    • InChI Key: RUKQPNZJSFPVFH-UHFFFAOYSA-N
    • SMILES: S(CC)C1=C(SC(=S)S1)SCC

Computed Properties

  • Exact Mass: 253.93860619g/mol
  • Monoisotopic Mass: 253.93860619g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 5
  • Heavy Atom Count: 12
  • Rotatable Bond Count: 4
  • Complexity: 188
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 4.2
  • Topological Polar Surface Area: 133?2

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