ChemSpider 2D Image | N-(9-Ethyl-9H-carbazol-3-yl)-2-nitro-4-(trifluoromethyl)benzenesulfonamide | C21H16F3N3O4S

N-(9-Ethyl-9H-carbazol-3-yl)-2-nitro-4-(trifluoromethyl)benzenesulfonamide

  • Molecular FormulaC21H16F3N3O4S
  • Average mass463.430 Da
  • Monoisotopic mass463.081360 Da
  • ChemSpider ID32739391

More details:






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

Benzenesulfonamide, N-(9-ethyl-9H-carbazol-3-yl)-2-nitro-4-(trifluoromethyl)- [ACD/Index Name]
N-(9-Ethyl-9H-carbazol-3-yl)-2-nitro-4-(trifluormethyl)benzolsulfonamid [German] [ACD/IUPAC Name]
N-(9-Ethyl-9H-carbazol-3-yl)-2-nitro-4-(trifluoromethyl)benzenesulfonamide [ACD/IUPAC Name]
N-(9-Éthyl-9H-carbazol-3-yl)-2-nitro-4-(trifluorométhyl)benzènesulfonamide [French] [ACD/IUPAC Name]
1196109-25-7 [RN]
cardiosulfa
N-(9-ETHYL-9H-CARBAZOL-3-YL)-2-NITRO-4-(TRIFLUOROMETHYL)BENZENE-1-SULFONAMIDE
N-(9-ETHYLCARBAZOL-3-YL)-2-NITRO-4-(TRIFLUOROMETHYL)BENZENESULFONAMIDE

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.5±0.1 g/cm3
Boiling Point: 556.5±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 83.8±3.0 kJ/mol
Flash Point: 290.4±32.9 °C
Index of Refraction: 1.637
Molar Refractivity: 111.5±0.5 cm3
#H bond acceptors: 7
#H bond donors: 1
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 1
ACD/LogP: 5.97
ACD/LogD (pH 5.5): 5.49
ACD/BCF (pH 5.5): 8666.26
ACD/KOC (pH 5.5): 22861.47
ACD/LogD (pH 7.4): 5.24
ACD/BCF (pH 7.4): 4968.29
ACD/KOC (pH 7.4): 13106.28
Polar Surface Area: 105 Å2
Polarizability: 44.2±0.5 10-24cm3
Surface Tension: 52.0±7.0 dyne/cm
Molar Volume: 310.6±7.0 cm3

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