ChemSpider 2D Image | 4-Chloro-N-[2-(diethylamino)ethyl]-N-isobutyl-2-nitrobenzenesulfonamide | C16H26ClN3O4S

4-Chloro-N-[2-(diethylamino)ethyl]-N-isobutyl-2-nitrobenzenesulfonamide

  • Molecular FormulaC16H26ClN3O4S
  • Average mass391.913 Da
  • Monoisotopic mass391.133240 Da
  • ChemSpider ID33374689

More details:

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

4-Chlor-N-[2-(diethylamino)ethyl]-N-isobutyl-2-nitrobenzolsulfonamid [German] [ACD/IUPAC Name]
4-Chloro-N-[2-(diethylamino)ethyl]-N-isobutyl-2-nitrobenzenesulfonamide [ACD/IUPAC Name]
4-Chloro-N-[2-(diéthylamino)éthyl]-N-isobutyl-2-nitrobenzènesulfonamide [French] [ACD/IUPAC Name]
Benzenesulfonamide, 4-chloro-N-[2-(diethylamino)ethyl]-N-(2-methylpropyl)-2-nitro- [ACD/Index Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 485.2±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 75.1±3.0 kJ/mol
Flash Point: 247.2±31.5 °C
Index of Refraction: 1.544
Molar Refractivity: 100.5±0.4 cm3
#H bond acceptors: 7
#H bond donors: 0
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 1
ACD/LogP: 5.17
ACD/LogD (pH 5.5): 1.21
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 4.41
ACD/LogD (pH 7.4): 2.23
ACD/BCF (pH 7.4): 9.52
ACD/KOC (pH 7.4): 46.58
Polar Surface Area: 95 Å2
Polarizability: 39.8±0.5 10-24cm3
Surface Tension: 45.9±3.0 dyne/cm
Molar Volume: 318.4±3.0 cm3

Click to predict properties on the Chemicalize site


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