ChemSpider 2D Image | N~2~-[2-(Methylsulfonyl)ethyl]-5-nitro-2,4-pyridinediamine | C8H12N4O4S

N2-[2-(Methylsulfonyl)ethyl]-5-nitro-2,4-pyridinediamine

  • Molecular FormulaC8H12N4O4S
  • Average mass260.270 Da
  • Monoisotopic mass260.057922 Da
  • ChemSpider ID67877282

More details:

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

2,4-Pyridinediamine, N2-[2-(methylsulfonyl)ethyl]-5-nitro- [ACD/Index Name]
N2-[2-(Methylsulfonyl)ethyl]-5-nitro-2,4-pyridindiamin [German] [ACD/IUPAC Name]
N2-[2-(Methylsulfonyl)ethyl]-5-nitro-2,4-pyridinediamine [ACD/IUPAC Name]
N2-[2-(Méthylsulfonyl)éthyl]-5-nitro-2,4-pyridinediamine [French] [ACD/IUPAC Name]

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

Density: 1.5±0.1 g/cm3
Boiling Point: 642.4±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.9 mmHg at 25°C
Enthalpy of Vaporization: 94.8±3.0 kJ/mol
Flash Point: 342.3±31.5 °C
Index of Refraction: 1.630
Molar Refractivity: 60.6±0.4 cm3
#H bond acceptors: 8
#H bond donors: 3
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: -0.04
ACD/LogD (pH 5.5): 0.07
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 25.48
ACD/LogD (pH 7.4): 0.09
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 26.63
Polar Surface Area: 139 Å2
Polarizability: 24.0±0.5 10-24cm3
Surface Tension: 77.0±3.0 dyne/cm
Molar Volume: 170.3±3.0 cm3

Click to predict properties on the Chemicalize site


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