ChemSpider 2D Image | 5-(2-Chlorophenyl)-3-methyl-7-nitropyrazolo[3,4-b][1,4]benzodiazepine | C17H10ClN5O2

5-(2-Chlorophenyl)-3-methyl-7-nitropyrazolo[3,4-b][1,4]benzodiazepine

  • Molecular FormulaC17H10ClN5O2
  • Average mass351.747 Da
  • Monoisotopic mass351.052307 Da
  • ChemSpider ID25057259

More details:

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

5-(2-Chlorophenyl)-3-methyl-7-nitropyrazolo[3,4-b][1,4]benzodiazepine [ACD/IUPAC Name]
5-(2-Chlorophényl)-3-méthyl-7-nitropyrazolo[3,4-b][1,4]benzodiazépine [French] [ACD/IUPAC Name]
5-(2-Chlorphenyl)-3-methyl-7-nitropyrazolo[3,4-b][1,4]benzodiazepin [German] [ACD/IUPAC Name]
Pyrazolo[3,4-b][1,4]benzodiazepine, 5-(2-chlorophenyl)-3-methyl-7-nitro- [ACD/Index Name]

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

Density: 1.6±0.1 g/cm3
Boiling Point: 511.0±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 75.2±3.0 kJ/mol
Flash Point: 262.9±32.9 °C
Index of Refraction: 1.765
Molar Refractivity: 93.0±0.5 cm3
#H bond acceptors: 7
#H bond donors: 0
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 3.07
ACD/LogD (pH 5.5): 3.74
ACD/BCF (pH 5.5): 407.55
ACD/KOC (pH 5.5): 2562.41
ACD/LogD (pH 7.4): 3.74
ACD/BCF (pH 7.4): 411.87
ACD/KOC (pH 7.4): 2589.60
Polar Surface Area: 95 Å2
Polarizability: 36.9±0.5 10-24cm3
Surface Tension: 64.6±7.0 dyne/cm
Molar Volume: 224.8±7.0 cm3

Click to predict properties on the Chemicalize site


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