Cas no 618101-93-2 (1-(4-Fluorophenyl)-3-Phenyl-1H-Pyrazole-5-Carboxylic Acid)

1-(4-Fluorophenyl)-3-Phenyl-1H-Pyrazole-5-Carboxylic Acid structure
618101-93-2 structure
Product Name:1-(4-Fluorophenyl)-3-Phenyl-1H-Pyrazole-5-Carboxylic Acid
CAS No:618101-93-2
MF:C16H11FN2O2
MW:282.269147157669
MDL:MFCD05150591
CID:955406
PubChem ID:2769614
Update Time:2025-04-19

1-(4-Fluorophenyl)-3-Phenyl-1H-Pyrazole-5-Carboxylic Acid Chemical and Physical Properties

Names and Identifiers

    • 2-(4-fluoro-phenyl)-5-phenyl-2h-pyrazole-3-carboxylic acid
    • 1-(4-Fluorophenyl)-3-phenyl-1H-pyrazole-5-carboxylic acid
    • MFCD05150591
    • 618101-93-2
    • AKOS022631527
    • CS-0357837
    • 1-(4-Fluorophenyl)-3-Phenyl-1H-Pyrazole-5-CarboxylicAcid
    • 2-(4-fluorophenyl)-5-phenylpyrazole-3-carboxylic acid
    • DTXSID10377790
    • 1-(4-Fluorophenyl)-3-Phenyl-1H-Pyrazole-5-Carboxylic Acid
    • MDL: MFCD05150591
    • Inchi: 1S/C16H11FN2O2/c17-12-6-8-13(9-7-12)19-15(16(20)21)10-14(18-19)11-4-2-1-3-5-11/h1-10H,(H,20,21)
    • InChI Key: XZVHZHLRTMJELS-UHFFFAOYSA-N
    • SMILES: FC1C=CC(=CC=1)N1C(C(=O)O)=CC(C2C=CC=CC=2)=N1

Computed Properties

  • Exact Mass: 282.08053
  • Monoisotopic Mass: 282.08045576g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 21
  • Rotatable Bond Count: 3
  • Complexity: 365
  • 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: 3.5
  • Topological Polar Surface Area: 55.1?2

Experimental Properties

  • Density: 1.3±0.1 g/cm3
  • Boiling Point: 490.0±40.0 °C at 760 mmHg
  • Flash Point: 250.2±27.3 °C
  • PSA: 55.12
  • Vapor Pressure: 0.0±1.3 mmHg at 25°C

1-(4-Fluorophenyl)-3-Phenyl-1H-Pyrazole-5-Carboxylic Acid Security Information

1-(4-Fluorophenyl)-3-Phenyl-1H-Pyrazole-5-Carboxylic Acid Pricemore >>

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