ChemSpider 2D Image | 1-(tert-butyl) 3-methyl 4-amino-1H-pyrazole-1,3-dicarboxylate | C10H15N3O4

1-(tert-butyl) 3-methyl 4-amino-1H-pyrazole-1,3-dicarboxylate

  • Molecular FormulaC10H15N3O4
  • Average mass241.244 Da
  • Monoisotopic mass241.106262 Da
  • ChemSpider ID28600503

More details:

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

1-(tert-butyl) 3-methyl 4-amino-1H-pyrazole-1,3-dicarboxylate
1H-Pyrazole-1,3-dicarboxylic acid, 4-amino-, 1-(1,1-dimethylethyl) 3-methyl ester [ACD/Index Name]
3-Methyl 1-(2-methyl-2-propanyl) 4-amino-1H-pyrazole-1,3-dicarboxylate [ACD/IUPAC Name]
3-Methyl-1-(2-methyl-2-propanyl)-4-amino-1H-pyrazol-1,3-dicarboxylat [German] [ACD/IUPAC Name]
4-Amino-1H-pyrazole-1,3-dicarboxylate de 3-méthyle et de 1-(2-méthyl-2-propanyle) [French] [ACD/IUPAC Name]
923283-63-0 [RN]
1-O-tert-butyl 3-O-methyl 4-aminopyrazole-1,3-dicarboxylate
1-tert-Butyl 3-methyl 4-amino-1H-pyrazole-1,3-dicarboxylate
1-TERT-BUTYL-3-METHYL-4-AMINO-1H-PYRAZOLE-1,3-DICARBOXYLATE
AGN-PC-0HVOZL
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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: 362.1±45.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.8 mmHg at 25°C
    Enthalpy of Vaporization: 60.8±3.0 kJ/mol
    Flash Point: 172.8±28.7 °C
    Index of Refraction: 1.547
    Molar Refractivity: 59.3±0.5 cm3
    #H bond acceptors: 7
    #H bond donors: 2
    #Freely Rotating Bonds: 4
    #Rule of 5 Violations: 0
    ACD/LogP: 1.49
    ACD/LogD (pH 5.5): 1.63
    ACD/BCF (pH 5.5): 10.24
    ACD/KOC (pH 5.5): 183.99
    ACD/LogD (pH 7.4): 1.63
    ACD/BCF (pH 7.4): 10.24
    ACD/KOC (pH 7.4): 183.99
    Polar Surface Area: 96 Å2
    Polarizability: 23.5±0.5 10-24cm3
    Surface Tension: 44.0±7.0 dyne/cm
    Molar Volume: 186.9±7.0 cm3

    Click to predict properties on the Chemicalize site


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