ChemSpider 2D Image | 1-(6,7,8,9-Tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-3-ylmethyl)-1H-pyrazol-4-amine | C11H16N6

1-(6,7,8,9-Tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-3-ylmethyl)-1H-pyrazol-4-amine

  • Molecular FormulaC11H16N6
  • Average mass232.285 Da
  • Monoisotopic mass232.143646 Da
  • ChemSpider ID21805302

More details:

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

1-(6,7,8,9-Tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-3-ylmethyl)-1H-pyrazol-4-amin [German] [ACD/IUPAC Name]
1-(6,7,8,9-Tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-3-ylmethyl)-1H-pyrazol-4-amine [ACD/IUPAC Name]
1-(6,7,8,9-Tétrahydro-5H-[1,2,4]triazolo[4,3-a]azépin-3-ylméthyl)-1H-pyrazol-4-amine [French] [ACD/IUPAC Name]
1H-Pyrazol-4-amine, 1-[(6,7,8,9-tetrahydro-5H-1,2,4-triazolo[4,3-a]azepin-3-yl)methyl]- [ACD/Index Name]
1-({5H,6H,7H,8H,9H-[1,2,4]triazolo[4,3-a]azepin-3-yl}methyl)-1H-pyrazol-4-amine
1-(5H,6H,7H,8H,9H-1,2,4-triazolo[4,5-a]azaperhydroepin-3-ylmethyl)pyrazole-4-y lamine
1-(5H,6H,7H,8H,9H-1,2,4-triazolo[4,5-a]azaperhydroepin-3-ylmethyl)pyrazole-4-ylamine
1-(6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-3-ylmethyl)pyrazol-4-amine
1177352-10-1 [RN]
AGN-PC-07E387
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    Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

    Density: 1.5±0.1 g/cm3
    Boiling Point: 516.5±56.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.3 mmHg at 25°C
    Enthalpy of Vaporization: 78.9±3.0 kJ/mol
    Flash Point: 266.2±31.8 °C
    Index of Refraction: 1.762
    Molar Refractivity: 64.6±0.5 cm3
    #H bond acceptors: 6
    #H bond donors: 2
    #Freely Rotating Bonds: 2
    #Rule of 5 Violations: 0
    ACD/LogP: -0.10
    ACD/LogD (pH 5.5): 0.19
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 30.12
    ACD/LogD (pH 7.4): 0.20
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 30.73
    Polar Surface Area: 75 Å2
    Polarizability: 25.6±0.5 10-24cm3
    Surface Tension: 67.6±7.0 dyne/cm
    Molar Volume: 156.7±7.0 cm3

    Click to predict properties on the Chemicalize site


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