Cas no 26060-79-7 (Furo[3,4-d]pyrimidine-5,7-dione)

Furo[3,4-d]pyrimidine-5,7-dione structure
26060-79-7 structure
Product Name:Furo[3,4-d]pyrimidine-5,7-dione
CAS No:26060-79-7
MF:C6H2N2O3
MW:150.091681003571
CID:283765
PubChem ID:21782247
Update Time:2025-04-19

Furo[3,4-d]pyrimidine-5,7-dione Chemical and Physical Properties

Names and Identifiers

    • Furo[3,4-d]pyrimidine-5,7-dione
    • 4,5-Pyrimidinedicarboxylicanhydride (8CI)
    • 26060-79-7
    • DTXSID90617969
    • FT-0763847
    • SCHEMBL4071878
    • Inchi: 1S/C6H2N2O3/c9-5-3-1-7-2-8-4(3)6(10)11-5/h1-2H
    • InChI Key: UCOZXHDVSAVGFP-UHFFFAOYSA-N
    • SMILES: O1C(C2=C(C=NC=N2)C1=O)=O

Computed Properties

  • Exact Mass: 150.00656
  • Monoisotopic Mass: 150.00654193g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 5
  • Heavy Atom Count: 11
  • Rotatable Bond Count: 0
  • Complexity: 216
  • 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: -0.1
  • Topological Polar Surface Area: 69.2?2

Experimental Properties

  • PSA: 69.15
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