Cas no 883528-25-4 (2-(4-fluorophenyl)isonicotinic acid)

2-(4-fluorophenyl)isonicotinic acid structure
883528-25-4 structure
Product Name:2-(4-fluorophenyl)isonicotinic acid
CAS No:883528-25-4
MF:C12H8FNO2
MW:217.195826530457
MDL:MFCD14666481
CID:710406
PubChem ID:46313116
Update Time:2025-04-19

2-(4-fluorophenyl)isonicotinic acid Chemical and Physical Properties

Names and Identifiers

    • 4-Pyridinecarboxylicacid, 2-(4-fluorophenyl)-
    • 2-(2-CHLOROPHENYL)-ISONICOTINIC ACID
    • 2-(4-Fluorophenyl)isonicotinic acid
    • 2-(4-fluorophenyl)pyridine-4-carboxylic acid
    • 2-(-(2-MERCAPTOPHENYLIMINO)METHYL)PHENOL
    • 4-Pyridinecarboxylicacid,2-(4-fluorophenyl)
    • TS-03101
    • SCHEMBL1517490
    • DTXSID20673412
    • MFCD14666481
    • 883528-25-4
    • HUPROSZAFNBWQU-UHFFFAOYSA-N
    • F2167-3003
    • AKOS022305886
    • A1-19781
    • 2-(4-Fluorophenyl)isonicotinicacid
    • 2-(4-fluorophenyl)isonicotinic acid
    • MDL: MFCD14666481
    • Inchi: 1S/C12H8FNO2/c13-10-3-1-8(2-4-10)11-7-9(12(15)16)5-6-14-11/h1-7H,(H,15,16)
    • InChI Key: HUPROSZAFNBWQU-UHFFFAOYSA-N
    • SMILES: FC1C=CC(=CC=1)C1C=C(C(=O)O)C=CN=1

Computed Properties

  • Exact Mass: 233.02400
  • Monoisotopic Mass: 217.054
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 16
  • Rotatable Bond Count: 2
  • Complexity: 251
  • 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
  • Topological Polar Surface Area: 50.2A^2
  • Surface Charge: 0
  • Tautomer Count: nothing
  • XLogP3: nothing

Experimental Properties

  • PSA: 50.19000
  • LogP: 3.10020

2-(4-fluorophenyl)isonicotinic acid Pricemore >>

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2-(4-fluorophenyl)isonicotinic acid Production Method

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