ChemSpider 2D Image | 8-Bromo-6-[2-fluoro(~2~H_4_)phenyl]-1-methyl-4H-[1,2,4]triazolo[4,3-a][1,4]benzodiazepine | C17H8D4BrFN4

8-Bromo-6-[2-fluoro(2H4)phenyl]-1-methyl-4H-[1,2,4]triazolo[4,3-a][1,4]benzodiazepine

  • Molecular FormulaC17H8D4BrFN4
  • Average mass375.231 Da
  • Monoisotopic mass374.048035 Da
  • ChemSpider ID103835275

  • Non-standard isotope - Non-standard isotope

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-6-(6-fluorophenyl-2,3,4,5-d4)-1-methyl- [ACD/Index Name]
8-Brom-6-[2-fluor(2H4)phenyl]-1-methyl-4H-[1,2,4]triazolo[4,3-a][1,4]benzodiazepin [German] [ACD/IUPAC Name]
8-Bromo-6-[2-fluoro(2H4)phenyl]-1-methyl-4H-[1,2,4]triazolo[4,3-a][1,4]benzodiazepine [ACD/IUPAC Name]
8-Bromo-6-[2-fluoro(2H4)phényl]-1-méthyl-4H-[1,2,4]triazolo[4,3-a][1,4]benzodiazépine [French] [ACD/IUPAC Name]
Flubromazolam-d4

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

Density: 1.6±0.1 g/cm3
Boiling Point: 520.6±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.4 mmHg at 25°C
Enthalpy of Vaporization: 79.4±3.0 kJ/mol
Flash Point: 268.6±32.9 °C
Index of Refraction: 1.715
Molar Refractivity: 91.1±0.5 cm3
#H bond acceptors: 4
#H bond donors: 0
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: 2.29
ACD/LogD (pH 5.5): 2.50
ACD/BCF (pH 5.5): 46.73
ACD/KOC (pH 5.5): 545.19
ACD/LogD (pH 7.4): 2.50
ACD/BCF (pH 7.4): 46.80
ACD/KOC (pH 7.4): 546.01
Polar Surface Area: 43 Å2
Polarizability: 36.1±0.5 10-24cm3
Surface Tension: 51.6±7.0 dyne/cm
Molar Volume: 231.7±7.0 cm3

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