Cas no 885275-92-3 (Ethyl 2,2-dimethyl-4,4,4-trifluorobutyrate)

Ethyl 2,2-dimethyl-4,4,4-trifluorobutyrate structure
885275-92-3 structure
Product Name:Ethyl 2,2-dimethyl-4,4,4-trifluorobutyrate
CAS No:885275-92-3
MF:C8H13F3O2
MW:198.182833433151
MDL:MFCD07784244
CID:2618608
PubChem ID:9990309
Update Time:2025-04-21

Ethyl 2,2-dimethyl-4,4,4-trifluorobutyrate Chemical and Physical Properties

Names and Identifiers

    • Ethyl 4,4,4-trifluoro-2,2-dimethylbutanoate
    • ETHYL 2,2-DIMETHYL-4,4,4-TRIFLUOROBUTYRATE
    • AKOS006345489
    • ethyl-4,4,4-trifluoro-2,2-dimethylbutanoate
    • 885275-92-3
    • MFCD07784244
    • DTXSID00433758
    • SCHEMBL761783
    • Ethyl 2,2-dimethyl-4,4,4-trifluorobutyrate
    • MDL: MFCD07784244
    • Inchi: 1S/C8H13F3O2/c1-4-13-6(12)7(2,3)5-8(9,10)11/h4-5H2,1-3H3
    • InChI Key: FGJANYYQTMRUHY-UHFFFAOYSA-N
    • SMILES: FC(CC(C(=O)OCC)(C)C)(F)F

Computed Properties

  • Exact Mass: 198.08676414Da
  • Monoisotopic Mass: 198.08676414Da
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 5
  • Heavy Atom Count: 13
  • Rotatable Bond Count: 4
  • Complexity: 184
  • 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: 26.3?2

Ethyl 2,2-dimethyl-4,4,4-trifluorobutyrate Security Information

Ethyl 2,2-dimethyl-4,4,4-trifluorobutyrate Pricemore >>

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