Cas no 117598-42-2 (1H-Pyrazole, 1-(fluoromethyl)-)

1H-Pyrazole, 1-(fluoromethyl)- structure
117598-42-2 structure
Product Name:1H-Pyrazole, 1-(fluoromethyl)-
CAS No:117598-42-2
MF:C4H5FN2
MW:100.094303846359
CID:3658962
PubChem ID:67077490
Update Time:2025-04-22

1H-Pyrazole, 1-(fluoromethyl)- Chemical and Physical Properties

Names and Identifiers

    • 1H-Pyrazole, 1-(fluoromethyl)-
    • 117598-42-2
    • 1-(fluoromethyl)pyrazole
    • fluoromethyl 1h pyrazol
    • 1-fluoromethyl-1h-pyrazole
    • G18765
    • SCHEMBL1563930
    • MFCD31416626
    • Inchi: 1S/C4H5FN2/c5-4-7-3-1-2-6-7/h1-3H,4H2
    • InChI Key: YTVWHWVFMFLPKF-UHFFFAOYSA-N
    • SMILES: FCN1C=CC=N1

Computed Properties

  • Exact Mass: 100.04367633g/mol
  • Monoisotopic Mass: 100.04367633g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 7
  • Rotatable Bond Count: 1
  • Complexity: 57.7
  • 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: 0
  • Topological Polar Surface Area: 17.8?2

1H-Pyrazole, 1-(fluoromethyl)- Pricemore >>

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