Cas no 13719-80-7 (Diethyl 3,4,5,6-tetrafluorophthalate)

Diethyl 3,4,5,6-tetrafluorophthalate structure
13719-80-7 structure
Product Name:Diethyl 3,4,5,6-tetrafluorophthalate
CAS No:13719-80-7
MF:C12H10F4O4
MW:294.199018001556
CID:2915105
PubChem ID:22011351
Update Time:2025-04-21

Diethyl 3,4,5,6-tetrafluorophthalate Chemical and Physical Properties

Names and Identifiers

    • SCHEMBL6578769
    • DB-220354
    • DTXSID401334620
    • 13719-80-7
    • diethyl3,4,5,6-tetrafluorophthalate
    • Diethyl 3,4,5,6-tetrafluorophthalate
    • Inchi: 1S/C12H10F4O4/c1-3-19-11(17)5-6(12(18)20-4-2)8(14)10(16)9(15)7(5)13/h3-4H2,1-2H3
    • InChI Key: YQSPVGBYBRQSDH-UHFFFAOYSA-N
    • SMILES: FC1=C(C(=C(C(C(=O)OCC)=C1C(=O)OCC)F)F)F

Computed Properties

  • Exact Mass: 294.05152144Da
  • Monoisotopic Mass: 294.05152144Da
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 8
  • Heavy Atom Count: 20
  • Rotatable Bond Count: 6
  • Complexity: 331
  • 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: 2.8
  • Topological Polar Surface Area: 52.6?2
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