ChemSpider 2D Image | 4-Chloro-N-[2-(4-methyl-1-piperazinyl)-5-(trifluoromethyl)phenyl]-3-nitrobenzenesulfonamide | C18H18ClF3N4O4S

4-Chloro-N-[2-(4-methyl-1-piperazinyl)-5-(trifluoromethyl)phenyl]-3-nitrobenzenesulfonamide

  • Molecular FormulaC18H18ClF3N4O4S
  • Average mass478.873 Da
  • Monoisotopic mass478.068939 Da
  • ChemSpider ID67091092

More details:

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

4-Chlor-N-[2-(4-methyl-1-piperazinyl)-5-(trifluormethyl)phenyl]-3-nitrobenzolsulfonamid [German] [ACD/IUPAC Name]
4-Chloro-N-[2-(4-methyl-1-piperazinyl)-5-(trifluoromethyl)phenyl]-3-nitrobenzenesulfonamide [ACD/IUPAC Name]
4-Chloro-N-[2-(4-méthyl-1-pipérazinyl)-5-(trifluorométhyl)phényl]-3-nitrobenzènesulfonamide [French] [ACD/IUPAC Name]
Benzenesulfonamide, 4-chloro-N-[2-(4-methyl-1-piperazinyl)-5-(trifluoromethyl)phenyl]-3-nitro- [ACD/Index 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: 567.1±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.6 mmHg at 25°C
Enthalpy of Vaporization: 85.1±3.0 kJ/mol
Flash Point: 296.8±32.9 °C
Index of Refraction: 1.596
Molar Refractivity: 108.7±0.4 cm3
#H bond acceptors: 8
#H bond donors: 1
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 1
ACD/LogP: 5.07
ACD/LogD (pH 5.5): 2.84
ACD/BCF (pH 5.5): 32.29
ACD/KOC (pH 5.5): 134.94
ACD/LogD (pH 7.4): 3.99
ACD/BCF (pH 7.4): 466.48
ACD/KOC (pH 7.4): 1949.25
Polar Surface Area: 107 Å2
Polarizability: 43.1±0.5 10-24cm3
Surface Tension: 53.5±3.0 dyne/cm
Molar Volume: 319.2±3.0 cm3

Click to predict properties on the Chemicalize site


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