Cas no 61206-59-5 (Acetic acid, difluoro(trifluoromethoxy)-, ethyl ester)

Acetic acid, difluoro(trifluoromethoxy)-, ethyl ester structure
61206-59-5 structure
Product Name:Acetic acid, difluoro(trifluoromethoxy)-, ethyl ester
CAS No:61206-59-5
MF:C5H5F5O3
MW:208.083419561386
CID:488483
PubChem ID:71398268
Update Time:2025-04-19

Acetic acid, difluoro(trifluoromethoxy)-, ethyl ester Chemical and Physical Properties

Names and Identifiers

    • Acetic acid, difluoro(trifluoromethoxy)-, ethyl ester
    • ethyl 2,2-difluoro-2-(trifluoromethoxy)acetate
    • DTXSID80819713
    • Ethyl difluoro(trifluoromethoxy)acetate
    • 61206-59-5
    • Acetic acid, 2,2-difluoro-2-(trifluoromethoxy)-, ethyl ester
    • Inchi: 1S/C5H5F5O3/c1-2-12-3(11)4(6,7)13-5(8,9)10/h2H2,1H3
    • InChI Key: QXARNAVAVIXNBD-UHFFFAOYSA-N
    • SMILES: FC(C(=O)OCC)(OC(F)(F)F)F

Computed Properties

  • Exact Mass: 208.01585
  • Monoisotopic Mass: 208.01588483g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 8
  • Heavy Atom Count: 13
  • Rotatable Bond Count: 4
  • Complexity: 187
  • 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: 35.5?2

Experimental Properties

  • PSA: 35.53
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