Cas no 290300-98-0 (3-(2-Methylphenyl)-4-pyridinecarboxylicacid)

3-(2-Methylphenyl)-4-pyridinecarboxylicacid structure
290300-98-0 structure
Product Name:3-(2-Methylphenyl)-4-pyridinecarboxylicacid
CAS No:290300-98-0
MF:C13H11NO2
MW:213.231943368912
MDL:MFCD03411670
CID:915320
PubChem ID:22000066
Update Time:2025-09-22

3-(2-Methylphenyl)-4-pyridinecarboxylicacid Chemical and Physical Properties

Names and Identifiers

    • 3-(2-Methylphenyl)-4-pyridinecarboxylicacid
    • 3-(2-methylphenyl)pyridine-4-carboxylic acid
    • MFCD03411670
    • A1-27246
    • SCHEMBL6870086
    • KDCSJERZLIJPLK-UHFFFAOYSA-N
    • 4-Pyridinecarboxylic acid, 3-(2-methylphenyl)-
    • 3-(o-tolyl)Isonicotinic acid
    • 3-(2-METHYLPHENYL)-4-PYRIDINECARBOXYLIC ACID
    • AKOS015155209
    • 3-o-tolyl-isonicotinic acid
    • 3-(2-METHYLPHENYL)ISONICOTINIC ACID
    • 290300-98-0
    • DTXSID60621371
    • MDL: MFCD03411670
    • Inchi: 1S/C13H11NO2/c1-9-4-2-3-5-10(9)12-8-14-7-6-11(12)13(15)16/h2-8H,1H3,(H,15,16)
    • InChI Key: KDCSJERZLIJPLK-UHFFFAOYSA-N
    • SMILES: OC(C1C=CN=CC=1C1C=CC=CC=1C)=O

Computed Properties

  • Exact Mass: 213.07903
  • 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
  • Surface Charge: 0
  • Tautomer Count: 4
  • XLogP3: 2.4
  • Topological Polar Surface Area: 50.2?2

Experimental Properties

  • PSA: 50.19

3-(2-Methylphenyl)-4-pyridinecarboxylicacid Pricemore >>

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