Cas no 52403-25-5 (2,6-Dimethyl-4-oxo-1,4-dihydropyridine-3-carboxylic acid)

2,6-Dimethyl-4-oxo-1,4-dihydropyridine-3-carboxylic acid structure
52403-25-5 structure
Product Name:2,6-Dimethyl-4-oxo-1,4-dihydropyridine-3-carboxylic acid
CAS No:52403-25-5
MF:C8H9NO3
MW:167.161962270737
CID:936837
PubChem ID:304687
Update Time:2025-04-19

2,6-Dimethyl-4-oxo-1,4-dihydropyridine-3-carboxylic acid Chemical and Physical Properties

Names and Identifiers

    • 2,6-Dimethyl-4-oxo-1,4-dihydropyridine-3-carboxylic acid
    • 2,6-dimethyl-4-oxo-1,4-dihydro-3-pyridinecarboxylic acid(SALTDATA: H2O)
    • 2,6-DIMETHYL-4-OXO-1,4-DIHYDROPYRIDINE-3-CARBOXYLIC ACID HYDRATE
    • 2,6-dimethyl-4-oxo-1H-pyridine-3-carboxylic acid
    • 33259-21-1
    • AKOS016005928
    • SB54419
    • DB-192116
    • NSC201304
    • C74708
    • SB52646
    • 4-Hydroxy-2,6-dimethylnicotinic acid
    • MFCD18258494
    • DB-340298
    • 2,6-Dimethyl-4-oxo-1,4-dihydropyridine-3-carboxylicacid
    • 2,6-dimethyl-4-oxo-1,4-dihydro-3-pyridinecarboxylic acid
    • AMY17311
    • DTXSID60966830
    • CS-0160835
    • DS-15222
    • 3-Pyridinecarboxylic acid, 4-hydroxy-2,6-dimethyl-
    • SXBRRFLLEOHXIO-UHFFFAOYSA-N
    • 4-Hydroxy-2,6-dimethylnicotinicacid
    • 2,6-dimethyl-4-hydroxy-nicotinic acid
    • NSC-201304
    • 4-Hydroxy-2,6-dimethyl-nicotinic acid
    • SCHEMBL10686284
    • 2,6dimethyl-4-hydroxy-nicotinic acid
    • SCHEMBL3559208
    • 52403-25-5
    • MDL: MFCD17078889
    • Inchi: 1S/C8H9NO3/c1-4-3-6(10)7(8(11)12)5(2)9-4/h3H,1-2H3,(H,9,10)(H,11,12)
    • InChI Key: SXBRRFLLEOHXIO-UHFFFAOYSA-N
    • SMILES: O=C1C=C(C)NC(C)=C1C(=O)O

Computed Properties

  • Exact Mass: 167.05827
  • Monoisotopic Mass: 167.058243149g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 2
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 12
  • Rotatable Bond Count: 1
  • Complexity: 312
  • 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: 1.2
  • Topological Polar Surface Area: 66.4?2

Experimental Properties

  • Density: 1.3±0.1 g/cm3
  • Boiling Point: 313.8±42.0 °C at 760 mmHg
  • Flash Point: 143.6±27.9 °C
  • PSA: 66.4
  • LogP: 0.68990
  • Vapor Pressure: 0.0±1.4 mmHg at 25°C

2,6-Dimethyl-4-oxo-1,4-dihydropyridine-3-carboxylic acid Security Information

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