ChemSpider 2D Image | N-Ethyl-N-[(1-ethyl-1H-pyrazol-4-yl)methyl]-1,4-butanediamine | C12H24N4

N-Ethyl-N-[(1-ethyl-1H-pyrazol-4-yl)methyl]-1,4-butanediamine

  • Molecular FormulaC12H24N4
  • Average mass224.346 Da
  • Monoisotopic mass224.200104 Da
  • ChemSpider ID35496640

More details:

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

1,4-Butanediamine, N1-ethyl-N1-[(1-ethyl-1H-pyrazol-4-yl)methyl]- [ACD/Index Name]
N-Ethyl-N-[(1-ethyl-1H-pyrazol-4-yl)methyl]-1,4-butandiamin [German] [ACD/IUPAC Name]
N-Ethyl-N-[(1-ethyl-1H-pyrazol-4-yl)methyl]-1,4-butanediamine [ACD/IUPAC Name]
N-Éthyl-N-[(1-éthyl-1H-pyrazol-4-yl)méthyl]-1,4-butanediamine [French] [ACD/IUPAC Name]
1708254-83-4 [RN]
MFCD26528522
n-ethyl-n-[(1-ethylpyrazol-4-yl)methyl]butane-1,4-diamine
N'-ethyl-N'-[(1-ethylpyrazol-4-yl)methyl]butane-1,4-diamine

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

    Density: 1.0±0.1 g/cm3
    Boiling Point: 323.3±22.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.7 mmHg at 25°C
    Enthalpy of Vaporization: 56.5±3.0 kJ/mol
    Flash Point: 149.3±22.3 °C
    Index of Refraction: 1.533
    Molar Refractivity: 67.8±0.5 cm3
    #H bond acceptors: 4
    #H bond donors: 2
    #Freely Rotating Bonds: 8
    #Rule of 5 Violations: 0
    ACD/LogP: 0.94
    ACD/LogD (pH 5.5): -3.24
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 1.00
    ACD/LogD (pH 7.4): -2.54
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 1.00
    Polar Surface Area: 47 Å2
    Polarizability: 26.9±0.5 10-24cm3
    Surface Tension: 38.0±7.0 dyne/cm
    Molar Volume: 218.6±7.0 cm3

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