Cas no 104887-33-4 (Butanedioic acid, methylene-, bis(2,2,3,3-tetrafluoropropyl) ester)

Butanedioic acid, methylene-, bis(2,2,3,3-tetrafluoropropyl) ester structure
104887-33-4 structure
Product Name:Butanedioic acid, methylene-, bis(2,2,3,3-tetrafluoropropyl) ester
CAS No:104887-33-4
MF:C11H10F8O4
MW:358.181931972504
CID:1146390
PubChem ID:54134710
Update Time:2025-04-20

Butanedioic acid, methylene-, bis(2,2,3,3-tetrafluoropropyl) ester Chemical and Physical Properties

Names and Identifiers

    • Butanedioic acid, methylene-, bis(2,2,3,3-tetrafluoropropyl) ester
    • bis(2,2,3,3-tetrafluoropropyl) 2-methylidenebutanedioate
    • SCHEMBL2367713
    • DTXSID70709255
    • Butanedioic acid, 2-methylene-, bis(2,2,3,3-tetrafluoropropyl) ester
    • 104887-33-4
    • NWVXNLSWQVBEGC-UHFFFAOYSA-N
    • Inchi: 1S/C11H10F8O4/c1-5(7(21)23-4-11(18,19)9(14)15)2-6(20)22-3-10(16,17)8(12)13/h8-9H,1-4H2
    • InChI Key: NWVXNLSWQVBEGC-UHFFFAOYSA-N
    • SMILES: FC(C(F)F)(COC(CC(=C)C(=O)OCC(C(F)F)(F)F)=O)F

Computed Properties

  • Exact Mass: 358.0451
  • Monoisotopic Mass: 358.04513409g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 12
  • Heavy Atom Count: 23
  • Rotatable Bond Count: 11
  • Complexity: 449
  • 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: 3.6
  • Topological Polar Surface Area: 52.6?2

Experimental Properties

  • PSA: 52.6

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