Cas no 3711-04-4 ([4,4'-Biisobenzofuran]-1,1',3,3'-tetrone)

[4,4'-Biisobenzofuran]-1,1',3,3'-tetrone structure
3711-04-4 structure
Product Name:[4,4'-Biisobenzofuran]-1,1',3,3'-tetrone
CAS No:3711-04-4
MF:C16H6O6
MW:294.21524477005
CID:1481130
PubChem ID:619497
Update Time:2025-04-21

[4,4'-Biisobenzofuran]-1,1',3,3'-tetrone Chemical and Physical Properties

Names and Identifiers

    • [4,4'-Biisobenzofuran]-1,1',3,3'-tetrone
    • 2,2':3,3'-Biphenyltetracarboxylic acid, 2,3:2',3'-dianhydride
    • ZQUUGNBTODQIDG-UHFFFAOYSA-N
    • SCHEMBL2087097
    • 3,3',4,4'-Biphenyltetracarboxylic acid, 3,4:3',4'-dianhydride
    • DTXSID70347257
    • 4-(1,3-dioxo-2-benzofuran-4-yl)-2-benzofuran-1,3-dione
    • 5,5'-Bis[isobenzofurane-1,3(1H,3H)-dione]
    • 3711-04-4
    • Inchi: 1S/C16H6O6/c17-13-9-5-1-3-7(11(9)15(19)21-13)8-4-2-6-10-12(8)16(20)22-14(10)18/h1-6H
    • InChI Key: ZQUUGNBTODQIDG-UHFFFAOYSA-N
    • SMILES: O1C(C2=CC=CC(=C2C1=O)C1C=CC=C2C(=O)OC(C=12)=O)=O

Computed Properties

  • Exact Mass: 294.01643791g/mol
  • Monoisotopic Mass: 294.01643791g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 6
  • Heavy Atom Count: 22
  • Rotatable Bond Count: 1
  • Complexity: 517
  • 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: 2.3
  • Topological Polar Surface Area: 86.7?2
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