Cas no 62652-55-5 (Disulfide, bis(1-oxopropyl))

Disulfide, bis(1-oxopropyl) structure
Disulfide, bis(1-oxopropyl) structure
Product Name:Disulfide, bis(1-oxopropyl)
CAS No:62652-55-5
MF:C6H10O2S2
MW:178.272399425507
CID:436424
PubChem ID:11975391
Update Time:2025-04-19

Disulfide, bis(1-oxopropyl) Chemical and Physical Properties

Names and Identifiers

    • Disulfide, bis(1-oxopropyl)
    • S-propanoylsulfanyl propanethioate
    • SCHEMBL1014297
    • 62652-55-5
    • DTXSID50475007
    • Inchi: 1S/C6H10O2S2/c1-3-5(7)9-10-6(8)4-2/h3-4H2,1-2H3
    • InChI Key: DYANTIMWJWOBIF-UHFFFAOYSA-N
    • SMILES: S(C(CC)=O)SC(CC)=O

Computed Properties

  • Exact Mass: 178.0123
  • Monoisotopic Mass: 178.01222190g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 10
  • Rotatable Bond Count: 5
  • Complexity: 118
  • 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: 1.4
  • Topological Polar Surface Area: 84.7?2

Experimental Properties

  • PSA: 34.14
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