ChemSpider 2D Image | 3-((tert-Butoxycarbonyl)(methyl)amino)-1-methyl-1H-pyrazole-5-carboxylic acid | C11H17N3O4

3-((tert-Butoxycarbonyl)(methyl)amino)-1-methyl-1H-pyrazole-5-carboxylic acid

  • Molecular FormulaC11H17N3O4
  • Average mass255.270 Da
  • Monoisotopic mass255.121902 Da
  • ChemSpider ID57422936

More details:

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

1692905-99-9 [RN]
1H-Pyrazole-5-carboxylic acid, 3-[[(1,1-dimethylethoxy)carbonyl]methylamino]-1-methyl- [ACD/Index Name]
1-Methyl-3-(methyl{[(2-methyl-2-propanyl)oxy]carbonyl}amino)-1H-pyrazol-5-carbonsäure [German] [ACD/IUPAC Name]
1-Methyl-3-(methyl{[(2-methyl-2-propanyl)oxy]carbonyl}amino)-1H-pyrazole-5-carboxylic acid [ACD/IUPAC Name]
3-((tert-Butoxycarbonyl)(methyl)amino)-1-methyl-1H-pyrazole-5-carboxylic acid
Acide 1-méthyl-3-(méthyl{[(2-méthyl-2-propanyl)oxy]carbonyl}amino)-1H-pyrazole-5-carboxylique [French] [ACD/IUPAC Name]
2-methyl-5-[methyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]pyrazole-3-carboxylic acid
3-((t-Butoxycarbonyl)(methyl)amino)-1-methyl-1H-pyrazole-5-carboxylic acid
3-{[(tert-butoxy)carbonyl](methyl)amino}-1-methyl-1H-pyrazole-5-carboxylic acid
5-[(tert-butoxycarbonyl)(methyl)amino]-2-methylpyrazole-3-carboxylic acid
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    Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

    Density: 1.2±0.1 g/cm3
    Boiling Point: 420.7±30.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.0 mmHg at 25°C
    Enthalpy of Vaporization: 71.1±3.0 kJ/mol
    Flash Point: 208.3±24.6 °C
    Index of Refraction: 1.543
    Molar Refractivity: 65.2±0.5 cm3
    #H bond acceptors: 7
    #H bond donors: 1
    #Freely Rotating Bonds: 4
    #Rule of 5 Violations: 0
    ACD/LogP: 1.14
    ACD/LogD (pH 5.5): -0.56
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 1.00
    ACD/LogD (pH 7.4): -1.24
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 1.00
    Polar Surface Area: 85 Å2
    Polarizability: 25.9±0.5 10-24cm3
    Surface Tension: 41.7±7.0 dyne/cm
    Molar Volume: 206.9±7.0 cm3

    Click to predict properties on the Chemicalize site


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