Cas no 100925-76-6 (Cyclopenta[b]thiophene-4,6-dione)

Cyclopenta[b]thiophene-4,6-dione structure
100925-76-6 structure
Product Name:Cyclopenta[b]thiophene-4,6-dione
CAS No:100925-76-6
MF:C7H4O2S
MW:152.170460700989
CID:1126544
PubChem ID:11084061
Update Time:2025-04-20

Cyclopenta[b]thiophene-4,6-dione Chemical and Physical Properties

Names and Identifiers

    • Cyclopenta[b]thiophene-4,6-dione
    • ACMC-20m3z4
    • cyclopenta&lt
    • b&gt
    • thiophene-4,6-dione
    • 5,6-dihydrocyclopenta&lt
    • thiophen-4,6-dione
    • 5,6-dihydro-4H-cyclopenta&lt
    • 4H-cyclopenta[b]thiophene-4,6(5H)-dione
    • CTK0G8562
    • SureCN10038365
    • ACMC-20m3z4; cyclopenta< b> thiophene-4,6-dione; 5,6-dihydrocyclopenta< b> thiophen-4,6-dione; 5,6-dihydro-4H-cyclopenta< b> thiophene-4,6-dione; 4H-cyclopenta[b]thiophene-4,6(5H)-dione; CTK0G8562; SureCN10038365; 4H-Cyclopenta[b]thiophene-4,6(5H)-dione;
    • 100925-76-6
    • SCHEMBL10038365
    • DTXSID40454548
    • Inchi： 1S/C7H4O2S/c8-5-3-6(9)7-4(5)1-2-10-7/h1-2H,3H2
    • InChI Key： ASZVXHKCNHBASK-UHFFFAOYSA-N
    • SMILES： S1C=CC2C(CC(C1=2)=O)=O

Computed Properties

  • Exact Mass: 151.99322
  • Monoisotopic Mass: 151.99320054g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 10
  • Rotatable Bond Count: 0
  • Complexity: 200
  • 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: 62.4?2

Experimental Properties

  • PSA: 34.14
  • LogP: 1.51720

Cyclopenta[b]thiophene-4,6-dione Related Literature

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