ChemSpider 2D Image | 2-Methyl-2-propanyl 4-(3-nitro-4-pyridinyl)-1-piperazinecarboxylate | C14H20N4O4

2-Methyl-2-propanyl 4-(3-nitro-4-pyridinyl)-1-piperazinecarboxylate

  • Molecular FormulaC14H20N4O4
  • Average mass308.333 Da
  • Monoisotopic mass308.148468 Da
  • ChemSpider ID48483362

More details:

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

1-Piperazinecarboxylic acid, 4-(3-nitro-4-pyridinyl)-, 1,1-dimethylethyl ester [ACD/Index Name]
1-Piperazinecarboxylic acid, 4-(3-nitro-4-pyridinyl)-, 1,1-dimethylethylester
2-Methyl-2-propanyl 4-(3-nitro-4-pyridinyl)-1-piperazinecarboxylate [ACD/IUPAC Name]
2-Methyl-2-propanyl-4-(3-nitro-4-pyridinyl)-1-piperazincarboxylat [German] [ACD/IUPAC Name]
4-(3-Nitro-4-pyridinyl)-1-pipérazinecarboxylate de 2-méthyl-2-propanyle [French] [ACD/IUPAC Name]
608142-93-4 [RN]
MFCD18207662
t-Butyl 4-(3-nitropyridin-4-yl)piperazine-1-carboxylate
tert-butyl 4-(3-nitropyridin-4-yl)piperazine-1-carboxylate

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

    Density: 1.3±0.1 g/cm3
    Boiling Point: 447.8±45.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.1 mmHg at 25°C
    Enthalpy of Vaporization: 70.6±3.0 kJ/mol
    Flash Point: 224.6±28.7 °C
    Index of Refraction: 1.562
    Molar Refractivity: 79.5±0.3 cm3
    #H bond acceptors: 8
    #H bond donors: 0
    #Freely Rotating Bonds: 4
    #Rule of 5 Violations: 0
    ACD/LogP: 2.31
    ACD/LogD (pH 5.5): 0.95
    ACD/BCF (pH 5.5): 1.61
    ACD/KOC (pH 5.5): 22.26
    ACD/LogD (pH 7.4): 2.08
    ACD/BCF (pH 7.4): 21.28
    ACD/KOC (pH 7.4): 295.16
    Polar Surface Area: 91 Å2
    Polarizability: 31.5±0.5 10-24cm3
    Surface Tension: 53.2±3.0 dyne/cm
    Molar Volume: 245.0±3.0 cm3

    Click to predict properties on the Chemicalize site


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