ChemSpider 2D Image | 4-(Methylsulfonyl)-N-[3-(trifluoromethyl)phenyl]benzenesulfonamide | C14H12F3NO4S2

4-(Methylsulfonyl)-N-[3-(trifluoromethyl)phenyl]benzenesulfonamide

  • Molecular FormulaC14H12F3NO4S2
  • Average mass379.375 Da
  • Monoisotopic mass379.015991 Da
  • ChemSpider ID31416149

More details:

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

4-(Methylsulfonyl)-N-[3-(trifluormethyl)phenyl]benzolsulfonamid [German] [ACD/IUPAC Name]
4-(Methylsulfonyl)-N-[3-(trifluoromethyl)phenyl]benzenesulfonamide [ACD/IUPAC Name]
4-(Méthylsulfonyl)-N-[3-(trifluorométhyl)phényl]benzènesulfonamide [French] [ACD/IUPAC Name]
Benzenesulfonamide, 4-(methylsulfonyl)-N-[3-(trifluoromethyl)phenyl]- [ACD/Index Name]
4-METHANESULFONYL-N-[3-(TRIFLUOROMETHYL)PHENYL]BENZENE-1-SULFONAMIDE
4-METHANESULFONYL-N-[3-(TRIFLUOROMETHYL)PHENYL]BENZENESULFONAMIDE

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

Density: 1.5±0.1 g/cm3
Boiling Point: 510.6±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 78.1±3.0 kJ/mol
Flash Point: 262.6±32.9 °C
Index of Refraction: 1.562
Molar Refractivity: 82.4±0.4 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 3.08
ACD/LogD (pH 5.5): 2.38
ACD/BCF (pH 5.5): 37.21
ACD/KOC (pH 5.5): 452.27
ACD/LogD (pH 7.4): 1.54
ACD/BCF (pH 7.4): 5.35
ACD/KOC (pH 7.4): 65.07
Polar Surface Area: 97 Å2
Polarizability: 32.7±0.5 10-24cm3
Surface Tension: 47.2±3.0 dyne/cm
Molar Volume: 253.8±3.0 cm3

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