ChemSpider 2D Image | 3-Bromo-10-methyl-9H-imidazo[1,5-a][1,2,4]triazolo[4,3-d][1,4]benzodiazepine | C13H10BrN5

3-Bromo-10-methyl-9H-imidazo[1,5-a][1,2,4]triazolo[4,3-d][1,4]benzodiazepine

  • Molecular FormulaC13H10BrN5
  • Average mass316.156 Da
  • Monoisotopic mass315.011963 Da
  • ChemSpider ID24632468

More details:

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

3-Brom-10-methyl-9H-imidazo[1,5-a][1,2,4]triazolo[4,3-d][1,4]benzodiazepin [German] [ACD/IUPAC Name]
3-Bromo-10-methyl-9H-imidazo[1,5-a][1,2,4]triazolo[4,3-d][1,4]benzodiazepine [ACD/IUPAC Name]
3-Bromo-10-méthyl-9H-imidazo[1,5-a][1,2,4]triazolo[4,3-d][1,4]benzodiazépine [French] [ACD/IUPAC Name]
9H-Imidazo[1,5-a][1,2,4]triazolo[4,3-d][1,4]benzodiazepine, 3-bromo-10-methyl- [ACD/Index Name]

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

Density: 1.8±0.1 g/cm3
Boiling Point: 564.4±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 84.8±3.0 kJ/mol
Flash Point: 295.2±32.9 °C
Index of Refraction: 1.826
Molar Refractivity: 76.7±0.5 cm3
#H bond acceptors: 5
#H bond donors: 0
#Freely Rotating Bonds: 0
#Rule of 5 Violations: 0
ACD/LogP: 2.68
ACD/LogD (pH 5.5): 2.09
ACD/BCF (pH 5.5): 22.22
ACD/KOC (pH 5.5): 309.21
ACD/LogD (pH 7.4): 2.14
ACD/BCF (pH 7.4): 25.13
ACD/KOC (pH 7.4): 349.72
Polar Surface Area: 49 Å2
Polarizability: 30.4±0.5 10-24cm3
Surface Tension: 66.6±7.0 dyne/cm
Molar Volume: 175.3±7.0 cm3

Click to predict properties on the Chemicalize site


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