ChemSpider 2D Image | 5-Methyl-4-oxo-2-thioxo-1,2,3,4-tetrahydropyrido[2,3-d]pyrimidine-7-carboxylic acid | C9H7N3O3S

5-Methyl-4-oxo-2-thioxo-1,2,3,4-tetrahydropyrido[2,3-d]pyrimidine-7-carboxylic acid

  • Molecular FormulaC9H7N3O3S
  • Average mass237.235 Da
  • Monoisotopic mass237.020813 Da
  • ChemSpider ID24790276

More details:

Validated by Experts, Validated by Users, Non-Validated, Removed by Users

5-Methyl-4-oxo-2-thioxo-1,2,3,4-tetrahydropyrido[2,3-d]pyrimidin-7-carbonsäure [German] [ACD/IUPAC Name]
5-Methyl-4-oxo-2-thioxo-1,2,3,4-tetrahydropyrido[2,3-d]pyrimidine-7-carboxylic acid [ACD/IUPAC Name]
Acide 5-méthyl-4-oxo-2-thioxo-1,2,3,4-tétrahydropyrido[2,3-d]pyrimidine-7-carboxylique [French] [ACD/IUPAC Name]
Pyrido[2,3-d]pyrimidine-7-carboxylic acid, 1,4-dihydro-2-mercapto-5-methyl-4-oxo- [ACD/Index Name]
1245570-19-7 [RN]
2-Mercapto-5-methyl-4-oxo-1,4-dihydro-pyrido[2,3-d]pyrimidine-7-carboxylic acid
5-methyl-4-oxo-2-sulfanyl-3,4-dihydropyrido[2,3-d]pyrimidine-7-carboxylic acid
5-methyl-4-oxo-2-sulfanylhydropyridino[2,3-d]pyrimidine-7-carboxylic acid
5-methyl-4-oxo-2-sulfanylidene-1H,2H,3H,4H-pyrido[2,3-d]pyrimidine-7-carboxylic acid
5-methyl-4-oxo-2-sulfanylidene-1H-pyrido[2,3-d]pyrimidine-7-carboxylic acid
More...

    Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

    Density: 1.8±0.1 g/cm3
    Boiling Point: 524.5±60.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.4 mmHg at 25°C
    Enthalpy of Vaporization: 84.0±3.0 kJ/mol
    Flash Point: 271.0±32.9 °C
    Index of Refraction: 1.807
    Molar Refractivity: 57.8±0.5 cm3
    #H bond acceptors: 6
    #H bond donors: 2
    #Freely Rotating Bonds: 1
    #Rule of 5 Violations: 0
    ACD/LogP: 0.26
    ACD/LogD (pH 5.5): -3.35
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 1.00
    ACD/LogD (pH 7.4): -3.56
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 1.00
    Polar Surface Area: 130 Å2
    Polarizability: 22.9±0.5 10-24cm3
    Surface Tension: 71.0±7.0 dyne/cm
    Molar Volume: 134.3±7.0 cm3

    Click to predict properties on the Chemicalize site


    Advertisement