ChemSpider 2D Image | N-(2-{[5-(Dimethylamino)-3-pyridazinyl]amino}ethyl)-4-methyl-3,5-dinitrobenzenesulfonamide | C15H19N7O6S

N-(2-{[5-(Dimethylamino)-3-pyridazinyl]amino}ethyl)-4-methyl-3,5-dinitrobenzenesulfonamide

  • Molecular FormulaC15H19N7O6S
  • Average mass425.420 Da
  • Monoisotopic mass425.111755 Da
  • ChemSpider ID58434655

More details:

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

Benzenesulfonamide, N-[2-[[5-(dimethylamino)-3-pyridazinyl]amino]ethyl]-4-methyl-3,5-dinitro- [ACD/Index Name]
N-(2-{[5-(Dimethylamino)-3-pyridazinyl]amino}ethyl)-4-methyl-3,5-dinitrobenzenesulfonamide [ACD/IUPAC Name]
N-(2-{[5-(Diméthylamino)-3-pyridazinyl]amino}éthyl)-4-méthyl-3,5-dinitrobenzènesulfonamide [French] [ACD/IUPAC Name]
N-(2-{[5-(Dimethylamino)-3-pyridazinyl]amino}ethyl)-4-methyl-3,5-dinitrobenzolsulfonamid [German] [ACD/IUPAC Name]
N-(2-((5-(dimethylamino)pyridazin-3-yl)amino)ethyl)-4-methyl-3,5-dinitrobenzenesulfonamide

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

Density: 1.5±0.1 g/cm3
Boiling Point: 695.7±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.2 mmHg at 25°C
Enthalpy of Vaporization: 101.9±3.0 kJ/mol
Flash Point: 374.6±34.3 °C
Index of Refraction: 1.637
Molar Refractivity: 102.3±0.4 cm3
#H bond acceptors: 13
#H bond donors: 2
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 1
ACD/LogP: 2.60
ACD/LogD (pH 5.5): -0.36
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.20
ACD/LogD (pH 7.4): 0.77
ACD/BCF (pH 7.4): 1.11
ACD/KOC (pH 7.4): 16.11
Polar Surface Area: 187 Å2
Polarizability: 40.5±0.5 10-24cm3
Surface Tension: 76.4±3.0 dyne/cm
Molar Volume: 284.8±3.0 cm3

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