ChemSpider 2D Image | 8-Bromo-1-methyl-6-phenyl-4H-[1,2,4]triazolo[4,3-a][1,4]benzodiazepine | C17H13BrN4

8-Bromo-1-methyl-6-phenyl-4H-[1,2,4]triazolo[4,3-a][1,4]benzodiazepine

  • Molecular FormulaC17H13BrN4
  • Average mass353.216 Da
  • Monoisotopic mass352.032349 Da
  • ChemSpider ID19871738

More details:

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

4H-[1,2,4]Triazolo[4,3-a][1,4]benzodiazepine, 8-bromo-1-methyl-6-phenyl- [ACD/Index Name]
71368-80-4 [RN]
8-Brom-1-methyl-6-phenyl-4H-[1,2,4]triazolo[4,3-a][1,4]benzodiazepin [German] [ACD/IUPAC Name]
8-Bromo-1-methyl-6-phenyl-4H-[1,2,4]triazolo[4,3-a][1,4]benzodiazepine [ACD/IUPAC Name]
8-Bromo-1-méthyl-6-phényl-4H-[1,2,4]triazolo[4,3-a][1,4]benzodiazépine [French] [ACD/IUPAC Name]
Bromazolam
4H-[1,2,4]Triazolo[4,3-a][1,4]benzodiazepine,8-bromo-1-methyl-6-phenyl-
8-bromo-1-methyl-6-phenyl-4H-benzo[f][1,2,4]triazolo[4,3-a][1,4]diazepine
MFCD28405606
Unii-ymc9OT97Z1

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

    Density: 1.5±0.0 g/cm3
    Boiling Point: 519.8±0.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.0 mmHg at 25°C
    Enthalpy of Vaporization: 79.3±0.0 kJ/mol
    Flash Point: 268.2±0.0 °C
    Index of Refraction: 1.728
    Molar Refractivity: 91.2±0.0 cm3
    #H bond acceptors: 4
    #H bond donors: 0
    #Freely Rotating Bonds: 1
    #Rule of 5 Violations: 0
    ACD/LogP: 1.86
    ACD/LogD (pH 5.5): 1.86
    ACD/BCF (pH 5.5): 15.26
    ACD/KOC (pH 5.5): 244.62
    ACD/LogD (pH 7.4): 1.86
    ACD/BCF (pH 7.4): 15.28
    ACD/KOC (pH 7.4): 245.08
    Polar Surface Area: 43 Å2
    Polarizability: 36.1±0.0 10-24cm3
    Surface Tension: 54.2±0.0 dyne/cm
    Molar Volume: 228.8±0.0 cm3

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