Cas no 479-64-1 (2,3,8,9-Tetrahydroxy-dibenzo[d,d']benzo[1,2-b;4,5-b']difuran-6,12-dion)

2,3,8,9-Tetrahydroxy-dibenzo[d,d']benzo[1,2-b;4,5-b']difuran-6,12-dion structure
479-64-1 structure
Product Name:2,3,8,9-Tetrahydroxy-dibenzo[d,d']benzo[1,2-b;4,5-b']difuran-6,12-dion
CAS No:479-64-1
MF:C18H8O8
MW:352.2513256073
CID:1996891
PubChem ID:135464206
Update Time:2025-04-21

2,3,8,9-Tetrahydroxy-dibenzo[d,d']benzo[1,2-b;4,5-b']difuran-6,12-dion Chemical and Physical Properties

Names and Identifiers

    • 4,5-b']difuran-6,12-dion
    • 2,3,8,9-tetrahydroxy-dibenzo[d,d']benzo[1,2-b
    • 4,5-b']difuran-6,12-dione
    • Thelephoric acid
    • 2,3,8,9-Tetrahydroxybenzo[1,2-b:4,5-b']bisbenzofuran-6,12-dione
    • 2,3,8,9-Tetrahydroxybenzo[1,2-b:4,5-b']bisbenzofuran-6,12-dione, 9CI
    • CHEMBL3236668
    • 2,3,8,9-Tetrahydroxybenzo[b][1]benzofuro[2,3-f][1]benzofuran-6,12-dione
    • Thelephorsaure
    • DTXSID201028792
    • 479-64-1
    • Benzo[1,2-b:4,5-b']bisbenzofuran-6,12-dione, 2,3,8,9-tetrahydroxy-
    • CHEBI:144238
    • 6,7,16,17-Tetrakis(oxidanyl)-10,20-dioxapentacyclo(11.7.0.03,11.04,9.014,19)icosa-1(13),3(11),4,6,8,14,16,18-octaene-2,12-dione
    • GGQ7FB8C8B
    • BDBM50008823
    • 2,3,8,9-Tetrahydroxy-dibenzo[d,d']benzo[1,2-b;4,5-b']difuran-6,12-dion
    • Inchi: 1S/C18H8O8/c19-7-1-5-11(3-9(7)21)25-17-13(5)15(23)18-14(16(17)24)6-2-8(20)10(22)4-12(6)26-18/h1-4,19-22H
    • InChI Key: PDICCECAPKBDBB-UHFFFAOYSA-N
    • SMILES: O1C2C=C(C(=CC=2C2C(C3=C(C(C1=2)=O)C1C=C(C(=CC=1O3)O)O)=O)O)O

Computed Properties

  • Exact Mass: 352.02191721g/mol
  • Monoisotopic Mass: 352.02191721g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 4
  • Hydrogen Bond Acceptor Count: 8
  • Heavy Atom Count: 26
  • Rotatable Bond Count: 0
  • Complexity: 583
  • 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: 2.9
  • Topological Polar Surface Area: 141?2
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