Cas no 1189440-85-4 (2,6-bis(4-methylpyridin-2-yl)pyridine-4-carboxylic acid)

2,6-bis(4-methylpyridin-2-yl)pyridine-4-carboxylic acid structure
1189440-85-4 structure
Product Name:2,6-bis(4-methylpyridin-2-yl)pyridine-4-carboxylic acid
CAS No:1189440-85-4
MF:C18H15N3O2
MW:305.330603837967
CID:1006433
PubChem ID:59514869
Update Time:2025-04-20

2,6-bis(4-methylpyridin-2-yl)pyridine-4-carboxylic acid Chemical and Physical Properties

Names and Identifiers

    • 2,6-bis(4-methylpyridin-2-yl)pyridine-4-carboxylic acid
    • 2,6-bis(4-methylpyridin-2-yl)pyridine-4-carboxylicacid
    • 1189440-85-4
    • SCHEMBL12992875
    • DB-216746
    • D88107
    • 4,4''-Dimethyl-2,2':6',2''-terpyridine-4'-carboxylic acid
    • J-400502
    • 4'-METHYL-6-(4-METHYLPYRIDIN-2-YL)-[2,2'-BIPYRIDINE]-4-CARBOXYLIC ACID
    • Inchi: 1S/C18H15N3O2/c1-11-3-5-19-14(7-11)16-9-13(18(22)23)10-17(21-16)15-8-12(2)4-6-20-15/h3-10H,1-2H3,(H,22,23)
    • InChI Key: NNBGWOGEUVTVCJ-UHFFFAOYSA-N
    • SMILES: OC(C1C=C(C2C=C(C)C=CN=2)N=C(C=1)C1C=C(C)C=CN=1)=O

Computed Properties

  • Exact Mass: 305.116426730g/mol
  • Monoisotopic Mass: 305.116426730g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 5
  • Heavy Atom Count: 23
  • Rotatable Bond Count: 3
  • Complexity: 387
  • 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: 2.4
  • Topological Polar Surface Area: 76?2
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