ChemSpider 2D Image | 5-(Dimethylamino)-9-methyl-2-(~2~H_7_)propyl-1H-pyrazolo[1,2-a][1,2,4]benzotriazine-1,3(2H)-dione | C16H13D7N4O2

5-(Dimethylamino)-9-methyl-2-(2H7)propyl-1H-pyrazolo[1,2-a][1,2,4]benzotriazine-1,3(2H)-dione

  • Molecular FormulaC16H13D7N4O2
  • Average mass307.399 Da
  • Monoisotopic mass307.202576 Da
  • ChemSpider ID58782020

  • Non-standard isotope - Non-standard isotope

More details:

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

1H-Pyrazolo[1,2-a][1,2,4]benzotriazine-1,3(2H)-dione, 5-(dimethylamino)-9-methyl-2-(propyl-d7)- [ACD/Index Name]
5-(Dimethylamino)-9-methyl-2-(2H7)propyl-1H-pyrazolo[1,2-a][1,2,4]benzotriazin-1,3(2H)-dion [German] [ACD/IUPAC Name]
5-(Dimethylamino)-9-methyl-2-(2H7)propyl-1H-pyrazolo[1,2-a][1,2,4]benzotriazine-1,3(2H)-dione [ACD/IUPAC Name]
5-(Diméthylamino)-9-méthyl-2-(2H7)propyl-1H-pyrazolo[1,2-a][1,2,4]benzotriazine-1,3(2H)-dione [French] [ACD/IUPAC Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 438.0±38.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 69.5±3.0 kJ/mol
Flash Point: 218.7±26.8 °C
Index of Refraction: 1.646
Molar Refractivity: 84.5±0.5 cm3
#H bond acceptors: 6
#H bond donors: 0
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 1.72
ACD/LogD (pH 5.5): 1.57
ACD/BCF (pH 5.5): 9.19
ACD/KOC (pH 5.5): 170.32
ACD/LogD (pH 7.4): 1.57
ACD/BCF (pH 7.4): 9.19
ACD/KOC (pH 7.4): 170.17
Polar Surface Area: 56 Å2
Polarizability: 33.5±0.5 10-24cm3
Surface Tension: 47.5±7.0 dyne/cm
Molar Volume: 232.8±7.0 cm3

Click to predict properties on the Chemicalize site


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