Cas no 1225547-21-6 (5-(3-Chlorophenyl)picolinic acid)

5-(3-Chlorophenyl)picolinic acid is a heterocyclic carboxylic acid derivative featuring a picolinic acid core substituted with a 3-chlorophenyl group. This compound is of interest in pharmaceutical and agrochemical research due to its potential as a building block for the synthesis of biologically active molecules. The presence of both a carboxylic acid and a chlorophenyl moiety enhances its utility in metal coordination and derivatization reactions. Its well-defined structure and moderate solubility in organic solvents make it suitable for use in cross-coupling reactions and ligand design. The compound is typically characterized by high purity and stability, ensuring reliable performance in synthetic applications.
5-(3-Chlorophenyl)picolinic acid structure
1225547-21-6 structure
Product Name:5-(3-Chlorophenyl)picolinic acid
CAS No:1225547-21-6
MF:C12H8ClNO2
MW:233.650422096252
CID:1036848
PubChem ID:50998560
Update Time:2025-10-15

5-(3-Chlorophenyl)picolinic acid Chemical and Physical Properties

Names and Identifiers

    • 5-(3-Chlorophenyl)picolinic acid
    • 5-(3-chlorophenyl)pyridine-2-carboxylic acid
    • DB-332583
    • 5-(3-Chlorophenyl)picolinicacid
    • EN300-6504337
    • 5-(3-Chlorophenyl)-picolinic acid
    • 1225547-21-6
    • AZB54721
    • DTXSID50679306
    • MFCD16317504
    • AKOS012255827
    • SCHEMBL21552113
    • 2-Pyridinecarboxylic acid, 5-(3-chlorophenyl)-
    • MDL： MFCD16317504
    • Inchi： 1S/C12H8ClNO2/c13-10-3-1-2-8(6-10)9-4-5-11(12(15)16)14-7-9/h1-7H,(H,15,16)
    • InChI Key： MJNAVDGXYYXWIU-UHFFFAOYSA-N
    • SMILES： ClC1=CC=CC(=C1)C1C=NC(C(=O)O)=CC=1

Computed Properties

  • Exact Mass: 233.0243562g/mol
  • Monoisotopic Mass: 233.0243562g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 16
  • Rotatable Bond Count: 2
  • Complexity: 259
  • 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
  • Topological Polar Surface Area: 50.2?2

5-(3-Chlorophenyl)picolinic acid Pricemore >>

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