Cas no 1250516-18-7 (1-(2-Fluorophenyl)-5-methyl-1H-pyrazole)

1-(2-Fluorophenyl)-5-methyl-1H-pyrazole is a fluorinated pyrazole derivative characterized by its aromatic substitution pattern, which enhances its utility in pharmaceutical and agrochemical research. The presence of a fluorine atom at the ortho position of the phenyl ring and a methyl group on the pyrazole core contributes to its unique electronic and steric properties, making it a valuable intermediate in the synthesis of bioactive compounds. Its structural features may improve metabolic stability and binding affinity in target molecules. This compound is commonly employed in medicinal chemistry for the development of enzyme inhibitors and receptor modulators due to its favorable physicochemical profile.
1-(2-Fluorophenyl)-5-methyl-1H-pyrazole structure
1250516-18-7 structure
Product Name:1-(2-Fluorophenyl)-5-methyl-1H-pyrazole
CAS No:1250516-18-7
MF:C10H9FN2
MW:176.190265417099
CID:1089268
PubChem ID:56956067
Update Time:2025-06-09

1-(2-Fluorophenyl)-5-methyl-1H-pyrazole Chemical and Physical Properties

Names and Identifiers

    • 1-(2-Fluorophenyl)-5-methyl-1H-pyrazole
    • 1-(2-fluorophenyl)-5-methylpyrazole
    • AKOS010087066
    • 1250516-18-7
    • DTXSID80718994
    • 1H-Pyrazole, 1-(2-fluorophenyl)-5-methyl-
    • Inchi: 1S/C10H9FN2/c1-8-6-7-12-13(8)10-5-3-2-4-9(10)11/h2-7H,1H3
    • InChI Key: GXRORDKMXQUAGB-UHFFFAOYSA-N
    • SMILES: FC1C=CC=CC=1N1C(C)=CC=N1

Computed Properties

  • Exact Mass: 176.07497646g/mol
  • Monoisotopic Mass: 176.07497646g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 13
  • Rotatable Bond Count: 1
  • 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: 2.4
  • Topological Polar Surface Area: 17.8?2

1-(2-Fluorophenyl)-5-methyl-1H-pyrazole Pricemore >>

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