Cas no 1226205-54-4 (5-(m-Tolyl)picolinic acid)

5-(m-Tolyl)picolinic acid structure
5-(m-Tolyl)picolinic acid structure
Product Name:5-(m-Tolyl)picolinic acid
CAS No:1226205-54-4
MF:C13H11NO2
MW:213.231943368912
MDL:MFCD16308581
CID:1036845
PubChem ID:50998547
Update Time:2025-04-20

5-(m-Tolyl)picolinic acid Chemical and Physical Properties

Names and Identifiers

    • 5-(m-Tolyl)picolinic acid
    • 5-(3-methylphenyl)pyridine-2-carboxylic acid
    • IFLCAKMPPRCRCG-UHFFFAOYSA-N
    • 5-(3-Methylphenyl)picolinic acid
    • MFCD16308581
    • 5-m-Tolyl-pyridine-2-carboxylic acid
    • DB-340569
    • DTXSID80679298
    • 2-Pyridinecarboxylic acid, 5-(3-methylphenyl)-
    • 5-(m-Tolyl)picolinicacid
    • SCHEMBL13680500
    • 5-(3-Methylphenyl)-picolinic acid
    • 1226205-54-4
    • AKOS012258414
    • A1-14826
    • MDL: MFCD16308581
    • Inchi: 1S/C13H11NO2/c1-9-3-2-4-10(7-9)11-5-6-12(13(15)16)14-8-11/h2-8H,1H3,(H,15,16)
    • InChI Key: IFLCAKMPPRCRCG-UHFFFAOYSA-N
    • SMILES: OC(C1=CC=C(C=N1)C1C=CC=C(C)C=1)=O

Computed Properties

  • Exact Mass: 213.078978594g/mol
  • Monoisotopic Mass: 213.078978594g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 16
  • Rotatable Bond Count: 2
  • Complexity: 254
  • 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: 2.7
  • Topological Polar Surface Area: 50.2?2

5-(m-Tolyl)picolinic acid Pricemore >>

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