ChemSpider 2D Image | 1-Isopropyl-5-methyl-1H-1,2,4-triazol-3-amine | C6H12N4

1-Isopropyl-5-methyl-1H-1,2,4-triazol-3-amine

  • Molecular FormulaC6H12N4
  • Average mass140.186 Da
  • Monoisotopic mass140.106201 Da
  • ChemSpider ID21636777

More details:

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

1H-1,2,4-Triazol-3-amine, 5-methyl-1-(1-methylethyl)- [ACD/Index Name]
1-Isopropyl-5-methyl-1H-1,2,4-triazol-3-amin [German] [ACD/IUPAC Name]
1-Isopropyl-5-methyl-1H-1,2,4-triazol-3-amine [ACD/IUPAC Name]
1-Isopropyl-5-méthyl-1H-1,2,4-triazol-3-amine [French] [ACD/IUPAC Name]
5-Methyl-1-(1-methylethyl)-1H-1,2,4-triazol-3-amine
938459-10-0 [RN]
MFCD09055360 [MDL number]
5-Methyl-1-(propan-2-yl)-1H-1,2,4-triazol-3-amine
5-methyl-1-propan-2-yl-1,2,4-triazol-3-amine

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

    Density: 1.2±0.1 g/cm3
    Boiling Point: 302.1±25.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.6 mmHg at 25°C
    Enthalpy of Vaporization: 54.2±3.0 kJ/mol
    Flash Point: 136.5±23.2 °C
    Index of Refraction: 1.596
    Molar Refractivity: 39.1±0.5 cm3
    #H bond acceptors: 4
    #H bond donors: 2
    #Freely Rotating Bonds: 1
    #Rule of 5 Violations: 0
    ACD/LogP: 0.01
    ACD/LogD (pH 5.5): 0.66
    ACD/BCF (pH 5.5): 1.58
    ACD/KOC (pH 5.5): 39.96
    ACD/LogD (pH 7.4): 0.94
    ACD/BCF (pH 7.4): 3.06
    ACD/KOC (pH 7.4): 77.29
    Polar Surface Area: 57 Å2
    Polarizability: 15.5±0.5 10-24cm3
    Surface Tension: 40.4±7.0 dyne/cm
    Molar Volume: 114.8±7.0 cm3

    Click to predict properties on the Chemicalize site


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