ChemSpider 2D Image | 3-Methyl-1-(1-methyl-1H-1,2,4-triazol-5-yl)-1-butanamine | C8H16N4

3-Methyl-1-(1-methyl-1H-1,2,4-triazol-5-yl)-1-butanamine

  • Molecular FormulaC8H16N4
  • Average mass168.239 Da
  • Monoisotopic mass168.137497 Da
  • ChemSpider ID21927834

More details:

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

1H-1,2,4-Triazole-5-methanamine, 1-methyl-α-(2-methylpropyl)- [ACD/Index Name]
3-Methyl-1-(1-methyl-1H-1,2,4-triazol-5-yl)-1-butanamin [German] [ACD/IUPAC Name]
3-Methyl-1-(1-methyl-1H-1,2,4-triazol-5-yl)-1-butanamine [ACD/IUPAC Name]
3-Méthyl-1-(1-méthyl-1H-1,2,4-triazol-5-yl)-1-butanamine [French] [ACD/IUPAC Name]
3-Methyl-1-(1-methyl-1H-1,2,4-triazol-5-yl)butan-1-amine
959239-65-7 [RN]
MFCD09864480 [MDL number]
1414778-78-1 [RN]
1414778-79-2 [RN]
3-methyl-1-(2-methyl-1,2,4-triazol-3-yl)butan-1-amine

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

    Density: 1.1±0.1 g/cm3
    Boiling Point: 293.6±42.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.6 mmHg at 25°C
    Enthalpy of Vaporization: 53.3±3.0 kJ/mol
    Flash Point: 131.4±27.9 °C
    Index of Refraction: 1.570
    Molar Refractivity: 48.3±0.5 cm3
    #H bond acceptors: 4
    #H bond donors: 2
    #Freely Rotating Bonds: 3
    #Rule of 5 Violations: 0
    ACD/LogP: 0.41
    ACD/LogD (pH 5.5): -1.58
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 1.00
    ACD/LogD (pH 7.4): 0.05
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 17.06
    Polar Surface Area: 57 Å2
    Polarizability: 19.1±0.5 10-24cm3
    Surface Tension: 38.6±7.0 dyne/cm
    Molar Volume: 147.2±7.0 cm3

    Click to predict properties on the Chemicalize site


    Advertisement