ChemSpider 2D Image | α-hydroxy Flubromazolam | C17H12BrFN4O

α-hydroxy Flubromazolam

  • Molecular FormulaC17H12BrFN4O
  • Average mass387.206 Da
  • Monoisotopic mass386.017853 Da
  • ChemSpider ID84400428

More details:






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

[8-Brom-6-(2-fluorphenyl)-4H-[1,2,4]triazolo[4,3-a][1,4]benzodiazepin-1-yl]methanol [German] [ACD/IUPAC Name]
[8-Bromo-6-(2-fluorophenyl)-4H-[1,2,4]triazolo[4,3-a][1,4]benzodiazepin-1-yl]methanol [ACD/IUPAC Name]
[8-Bromo-6-(2-fluorophényl)-4H-[1,2,4]triazolo[4,3-a][1,4]benzodiazépin-1-yl]méthanol [French] [ACD/IUPAC Name]
2204237-96-5 [RN]
4H-[1,2,4]Triazolo[4,3-a][1,4]benzodiazepine-1-methanol, 8-bromo-6-(2-fluorophenyl)- [ACD/Index Name]
α-hydroxy Flubromazolam
8-bromo-6-(2-fluorophenyl)-4H-[1,2,4]triazolo[4,3-a][1,4]benzodiazepine-1-methanol
α-hydroxy Flubromazolam

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.7±0.1 g/cm3
Boiling Point: 567.0±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.6 mmHg at 25°C
Enthalpy of Vaporization: 89.6±3.0 kJ/mol
Flash Point: 296.7±32.9 °C
Index of Refraction: 1.734
Molar Refractivity: 92.1±0.5 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 1.49
ACD/LogD (pH 5.5): 1.78
ACD/BCF (pH 5.5): 13.34
ACD/KOC (pH 5.5): 222.35
ACD/LogD (pH 7.4): 1.78
ACD/BCF (pH 7.4): 13.34
ACD/KOC (pH 7.4): 222.38
Polar Surface Area: 63 Å2
Polarizability: 36.5±0.5 10-24cm3
Surface Tension: 58.0±7.0 dyne/cm
Molar Volume: 229.9±7.0 cm3

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