Cas no 5200-38-4 (Ethyl 2,2,3,4,4,4-hexafluorobutanoate)

Ethyl 2,2,3,4,4,4-hexafluorobutanoate structure
5200-38-4 structure
Product Name:Ethyl 2,2,3,4,4,4-hexafluorobutanoate
CAS No:5200-38-4
MF:C6H6F6O2
MW:224.101063251495
CID:1575284
PubChem ID:56587777
Update Time:2025-04-21

Ethyl 2,2,3,4,4,4-hexafluorobutanoate Chemical and Physical Properties

Names and Identifiers

    • Ethyl 2,2,3,4,4,4-hexafluorobutanoate
    • MFCD16621309
    • DTXSID701023228
    • NRYRDKRQQXUDBX-UHFFFAOYSA-N
    • 5200-38-4
    • AKOS007930452
    • Ethyl 2,2,3,4,4,4-hexafluorobutyrate
    • Inchi: 1S/C6H6F6O2/c1-2-14-4(13)5(8,9)3(7)6(10,11)12/h3H,2H2,1H3
    • InChI Key: NRYRDKRQQXUDBX-UHFFFAOYSA-N
    • SMILES: FC(C(F)(F)F)C(C(=O)OCC)(F)F

Computed Properties

  • Exact Mass: 224.02719840g/mol
  • Monoisotopic Mass: 224.02719840g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 8
  • Heavy Atom Count: 14
  • Rotatable Bond Count: 4
  • Complexity: 211
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 1
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 2.7
  • Topological Polar Surface Area: 26.3?2
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