Cas no 1245773-06-1 (1-(2,2-difluoroethyl)-1H-pyrazole-3-carbonitrile)

1-(2,2-difluoroethyl)-1H-pyrazole-3-carbonitrile structure
1245773-06-1 structure
Product Name:1-(2,2-difluoroethyl)-1H-pyrazole-3-carbonitrile
CAS No:1245773-06-1
MF:C6H5F2N3
MW:157.120807409286
MDL:MFCD15976772
CID:3160320
PubChem ID:50896841
Update Time:2025-04-21

1-(2,2-difluoroethyl)-1H-pyrazole-3-carbonitrile Chemical and Physical Properties

Names and Identifiers

    • 1-(2,2-difluoroethyl)-1H-pyrazole-3-carbonitrile
    • SCHEMBL17395216
    • 1245773-06-1
    • STL584159
    • AKOS005169640
    • 1-(2,2-difluoroethyl)pyrazole-3-carbonitrile
    • EN300-232496
    • MDL： MFCD15976772
    • Inchi： 1S/C6H5F2N3/c7-6(8)4-11-2-1-5(3-9)10-11/h1-2,6H,4H2
    • InChI Key： VFDXINQYLMGHFR-UHFFFAOYSA-N
    • SMILES： FC(CN1C=CC(C#N)=N1)F

Computed Properties

  • Exact Mass: 157.04515350g/mol
  • Monoisotopic Mass: 157.04515350g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 11
  • Rotatable Bond Count: 2
  • Complexity: 174
  • 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: 1.1
  • Topological Polar Surface Area: 41.6?2

1-(2,2-difluoroethyl)-1H-pyrazole-3-carbonitrile Pricemore >>

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