ChemSpider 2D Image | 5-[(tert-butoxy)carbonyl]-1-methyl-1H,4H,5H,6H,7H-pyrazolo[4,3-c]pyridine-3-carboxylic acid | C13H19N3O4

5-[(tert-butoxy)carbonyl]-1-methyl-1H,4H,5H,6H,7H-pyrazolo[4,3-c]pyridine-3-carboxylic acid

  • Molecular FormulaC13H19N3O4
  • Average mass281.308 Da
  • Monoisotopic mass281.137543 Da
  • ChemSpider ID26457639

More details:

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

1306739-66-1 [RN]
1-Methyl-5-{[(2-methyl-2-propanyl)oxy]carbonyl}-4,5,6,7-tetrahydro-1H-pyrazolo[4,3-c]pyridin-3-carbonsäure [German] [ACD/IUPAC Name]
1-Methyl-5-{[(2-methyl-2-propanyl)oxy]carbonyl}-4,5,6,7-tetrahydro-1H-pyrazolo[4,3-c]pyridine-3-carboxylic acid [ACD/IUPAC Name]
5-[(tert-butoxy)carbonyl]-1-methyl-1H,4H,5H,6H,7H-pyrazolo[4,3-c]pyridine-3-carboxylic acid
5H-Pyrazolo[4,3-c]pyridine-3,5-dicarboxylic acid, 1,4,6,7-tetrahydro-1-methyl-, 5-(1,1-dimethylethyl) ester [ACD/Index Name]
Acide 1-méthyl-5-{[(2-méthyl-2-propanyl)oxy]carbonyl}-4,5,6,7-tétrahydro-1H-pyrazolo[4,3-c]pyridine-3-carboxylique [French] [ACD/IUPAC Name]
1-methyl-5-[(2-methylpropan-2-yl)oxycarbonyl]-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxylic acid
5-(tert-butoxycarbonyl)-1-methyl-4,5,6,7-tetrahydro-1H-pyrazolo[4,3-c]pyridine-3-carboxylic acid
5-(tert-Butoxycarbonyl)-1-methyl-4,5,6,7-tetrahy-dro-1H-pyrazolo[4,3-c]pyridine-3-carboxylic acid
5-(tert-butoxycarbonyl)-1-methyl-4H,6H,7H-pyrazolo[4,3-c]pyridine-3-carboxylic acid
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    Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

    Density: 1.3±0.1 g/cm3
    Boiling Point: 461.6±45.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.2 mmHg at 25°C
    Enthalpy of Vaporization: 76.1±3.0 kJ/mol
    Flash Point: 232.9±28.7 °C
    Index of Refraction: 1.597
    Molar Refractivity: 72.1±0.5 cm3
    #H bond acceptors: 7
    #H bond donors: 1
    #Freely Rotating Bonds: 3
    #Rule of 5 Violations: 0
    ACD/LogP: 0.37
    ACD/LogD (pH 5.5): 0.41
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 7.93
    ACD/LogD (pH 7.4): -1.02
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 1.00
    Polar Surface Area: 85 Å2
    Polarizability: 28.6±0.5 10-24cm3
    Surface Tension: 47.7±7.0 dyne/cm
    Molar Volume: 211.4±7.0 cm3

    Click to predict properties on the Chemicalize site


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