ChemSpider 2D Image | MFCD06656721 | C13H22N4O2

MFCD06656721

  • Molecular FormulaC13H22N4O2
  • Average mass266.339 Da
  • Monoisotopic mass266.174286 Da
  • ChemSpider ID26951727

More details:

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

1396986-72-3 [RN]
1-Piperidinecarboxylic acid, 2-(5-amino-1H-pyrazol-3-yl)-, 1,1-dimethylethyl ester [ACD/Index Name]
2-(5-Amino-1H-pyrazol-3-yl)-1-pipéridinecarboxylate de 2-méthyl-2-propanyle [French] [ACD/IUPAC Name]
2-Methyl-2-propanyl 2-(5-amino-1H-pyrazol-3-yl)-1-piperidinecarboxylate [ACD/IUPAC Name]
2-Methyl-2-propanyl-2-(5-amino-1H-pyrazol-3-yl)-1-piperidincarboxylat [German] [ACD/IUPAC Name]
MFCD06656721
tert-Butyl 2-(5-amino-1H-pyrazol-3-yl)-1-piperidinecarboxylate
TERT-BUTYL 2-(5-AMINO-1H-PYRAZOL-3-YL)PIPERIDINE-1-CARBOXYLATE
1946001-64-4 [RN]
2-(5-AMINO-1H-PYRAZOL-3-YL)-PIPERIDINE-1-CARBOXYLIC ACID TERT-BUTYL ESTER
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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: 465.1±45.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.1 mmHg at 25°C
    Enthalpy of Vaporization: 72.7±3.0 kJ/mol
    Flash Point: 235.1±28.7 °C
    Index of Refraction: 1.566
    Molar Refractivity: 72.6±0.3 cm3
    #H bond acceptors: 6
    #H bond donors: 3
    #Freely Rotating Bonds: 3
    #Rule of 5 Violations: 0
    ACD/LogP: 1.11
    ACD/LogD (pH 5.5): 1.40
    ACD/BCF (pH 5.5): 6.14
    ACD/KOC (pH 5.5): 113.24
    ACD/LogD (pH 7.4): 1.58
    ACD/BCF (pH 7.4): 9.25
    ACD/KOC (pH 7.4): 170.79
    Polar Surface Area: 84 Å2
    Polarizability: 28.8±0.5 10-24cm3
    Surface Tension: 54.7±3.0 dyne/cm
    Molar Volume: 222.7±3.0 cm3

    Click to predict properties on the Chemicalize site


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