ChemSpider 2D Image | 3-(5-Amino-2H-benzotriazol-2-yl)benzoic acid | C13H10N4O2

3-(5-Amino-2H-benzotriazol-2-yl)benzoic acid

  • Molecular FormulaC13H10N4O2
  • Average mass254.244 Da
  • Monoisotopic mass254.080383 Da
  • ChemSpider ID21481257

More details:

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

3-(5-amino-2H-1,2,3-benzotriazol-2-yl)benzoic acid
3-(5-Amino-2H-benzotriazol-2-yl)benzoesäure [German] [ACD/IUPAC Name]
3-(5-Amino-2H-benzotriazol-2-yl)benzoic acid [ACD/IUPAC Name]
873994-06-0 [RN]
Acide 3-(5-amino-2H-benzotriazol-2-yl)benzoïque [French] [ACD/IUPAC Name]
Benzoic acid, 3-(5-amino-2H-1,2,3-benzotriazol-2-yl)- [ACD/Index Name]
3-(5-Amino-2H-benzo[d][1,2,3]triazol-2-yl)benzoic acid
3-(5-aminobenzotriazol-2-yl)benzoic acid
3-(5-Amino-benzotriazol-2-yl)-benzoic acid
benzoic acid, 3-(5-amino-2H-1,2,3-benzotriazol-2-yl)
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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: 571.7±56.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.7 mmHg at 25°C
    Enthalpy of Vaporization: 90.2±3.0 kJ/mol
    Flash Point: 299.6±31.8 °C
    Index of Refraction: 1.751
    Molar Refractivity: 68.5±0.5 cm3
    #H bond acceptors: 6
    #H bond donors: 3
    #Freely Rotating Bonds: 2
    #Rule of 5 Violations: 0
    ACD/LogP: 2.47
    ACD/LogD (pH 5.5): 0.82
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 12.01
    ACD/LogD (pH 7.4): -0.55
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 1.00
    Polar Surface Area: 94 Å2
    Polarizability: 27.2±0.5 10-24cm3
    Surface Tension: 69.0±7.0 dyne/cm
    Molar Volume: 167.9±7.0 cm3

    Click to predict properties on the Chemicalize site


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