ChemSpider 2D Image | 4-Chloro-N-[5-chloro-2-(1,2,4-triazolidin-1-yl)phenyl]-3-nitrobenzenesulfonamide | C14H13Cl2N5O4S

4-Chloro-N-[5-chloro-2-(1,2,4-triazolidin-1-yl)phenyl]-3-nitrobenzenesulfonamide

  • Molecular FormulaC14H13Cl2N5O4S
  • Average mass418.255 Da
  • Monoisotopic mass417.006531 Da
  • ChemSpider ID111116293

More details:

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

4-Chlor-N-[5-chlor-2-(1,2,4-triazolidin-1-yl)phenyl]-3-nitrobenzolsulfonamid [German] [ACD/IUPAC Name]
4-Chloro-N-[5-chloro-2-(1,2,4-triazolidin-1-yl)phenyl]-3-nitrobenzenesulfonamide [ACD/IUPAC Name]
4-Chloro-N-[5-chloro-2-(1,2,4-triazolidin-1-yl)phényl]-3-nitrobenzènesulfonamide [French] [ACD/IUPAC Name]
Benzenesulfonamide, 4-chloro-N-[5-chloro-2-(1,2,4-triazolidin-1-yl)phenyl]-3-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: 594.3±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.7 mmHg at 25°C
Enthalpy of Vaporization: 88.6±3.0 kJ/mol
Flash Point: 313.2±32.9 °C
Index of Refraction: 1.675
Molar Refractivity: 98.0±0.4 cm3
#H bond acceptors: 9
#H bond donors: 3
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 1.96
ACD/LogD (pH 5.5): 0.58
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 8.97
ACD/LogD (pH 7.4): 1.30
ACD/BCF (pH 7.4): 3.42
ACD/KOC (pH 7.4): 46.10
Polar Surface Area: 128 Å2
Polarizability: 38.9±0.5 10-24cm3
Surface Tension: 67.7±3.0 dyne/cm
Molar Volume: 260.9±3.0 cm3

Click to predict properties on the Chemicalize site


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