Cas no 62656-65-9 (Acetonitrile, [1,2,2,2-tetrafluoro-1-(trifluoromethyl)ethoxy]-)

Acetonitrile, [1,2,2,2-tetrafluoro-1-(trifluoromethyl)ethoxy]- structure
62656-65-9 structure
Product Name:Acetonitrile, [1,2,2,2-tetrafluoro-1-(trifluoromethyl)ethoxy]-
CAS No:62656-65-9
MF:C5H2F7NO
MW:225.064305782318
CID:436339
PubChem ID:71384124
Update Time:2025-04-19

Acetonitrile, [1,2,2,2-tetrafluoro-1-(trifluoromethyl)ethoxy]- Chemical and Physical Properties

Names and Identifiers

    • Acetonitrile, [1,2,2,2-tetrafluoro-1-(trifluoromethyl)ethoxy]-
    • 2-(1,1,1,2,3,3,3-heptafluoropropan-2-yloxy)acetonitrile
    • [(1,1,1,2,3,3,3-Heptafluoropropan-2-yl)oxy]acetonitrile
    • 62656-65-9
    • DTXSID20806400
    • Inchi: 1S/C5H2F7NO/c6-3(4(7,8)9,5(10,11)12)14-2-1-13/h2H2
    • InChI Key: PERIAHFTURTYMK-UHFFFAOYSA-N
    • SMILES: FC(C(F)(F)F)(C(F)(F)F)OCC#N

Computed Properties

  • Exact Mass: 225.00246
  • Monoisotopic Mass: 225.00246082g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 9
  • Heavy Atom Count: 14
  • Rotatable Bond Count: 2
  • Complexity: 231
  • 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: 2.4
  • Topological Polar Surface Area: 33?2

Experimental Properties

  • PSA: 33.02
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