ChemSpider 2D Image | N-[2-(3-amino-1H-1,2,4-triazol-5-yl)ethyl]benzamide | C11H13N5O

N-[2-(3-amino-1H-1,2,4-triazol-5-yl)ethyl]benzamide

  • Molecular FormulaC11H13N5O
  • Average mass231.254 Da
  • Monoisotopic mass231.112015 Da
  • ChemSpider ID28943542

More details:

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

N-[2-(3-Amino-1H-1,2,4-triazol-5-yl)ethyl]benzamid [German] [ACD/IUPAC Name]
N-[2-(3-Amino-1H-1,2,4-triazol-5-yl)éthyl]benzamide [French] [ACD/IUPAC Name]
108921-95-5 [RN]
AGN-PC-0DAWXA
AKOS025116456
BBL033396
Benzamide, N-[2-(3-amino-1H-1,2,4-triazol-5-yl)ethyl]- [ACD/Index Name]
benzamide, N-[2-(5-amino-4H-1,2,4-triazol-3-yl)ethyl]
benzamide, N-[2-(5-amino-4H-1,2,4-triazol-3-yl)ethyl]-
MFCD24859188 [MDL number]
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    Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

    Density: 1.3±0.1 g/cm3
    Boiling Point:
    Vapour Pressure:
    Enthalpy of Vaporization:
    Flash Point:
    Index of Refraction: 1.655
    Molar Refractivity: 63.8±0.3 cm3
    #H bond acceptors: 6
    #H bond donors: 4
    #Freely Rotating Bonds: 4
    #Rule of 5 Violations: 0
    ACD/LogP: -0.04
    ACD/LogD (pH 5.5): 0.43
    ACD/BCF (pH 5.5): 1.20
    ACD/KOC (pH 5.5): 38.36
    ACD/LogD (pH 7.4): 0.48
    ACD/BCF (pH 7.4): 1.36
    ACD/KOC (pH 7.4): 43.34
    Polar Surface Area: 97 Å2
    Polarizability: 25.3±0.5 10-24cm3
    Surface Tension: 71.5±3.0 dyne/cm
    Molar Volume: 174.0±3.0 cm3

    Click to predict properties on the Chemicalize site


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