ChemSpider 2D Image | N-[1-Phenyl-2-(2H-1,2,3-triazol-2-yl)ethyl]-4-(trifluoromethoxy)benzenesulfonamide | C17H15F3N4O3S

N-[1-Phenyl-2-(2H-1,2,3-triazol-2-yl)ethyl]-4-(trifluoromethoxy)benzenesulfonamide

  • Molecular FormulaC17H15F3N4O3S
  • Average mass412.386 Da
  • Monoisotopic mass412.081696 Da
  • ChemSpider ID39183040

More details:

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

Benzenesulfonamide, N-[1-phenyl-2-(2H-1,2,3-triazol-2-yl)ethyl]-4-(trifluoromethoxy)- [ACD/Index Name]
N-[1-Phenyl-2-(2H-1,2,3-triazol-2-yl)ethyl]-4-(trifluormethoxy)benzolsulfonamid [German] [ACD/IUPAC Name]
N-[1-Phenyl-2-(2H-1,2,3-triazol-2-yl)ethyl]-4-(trifluoromethoxy)benzenesulfonamide [ACD/IUPAC Name]
N-[1-Phényl-2-(2H-1,2,3-triazol-2-yl)éthyl]-4-(trifluorométhoxy)benzènesulfonamide [French] [ACD/IUPAC Name]
2034406-80-7 [RN]
N-(1-phenyl-2-(2H-1,2,3-triazol-2-yl)ethyl)-4-(trifluoromethoxy)benzenesulfonamide
N-[1-phenyl-2-(2H-1,2,3-triazol-2-yl)ethyl]-4-(trifluoromethoxy)benzene-1-sulfonamide

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

Density: 1.4±0.1 g/cm3
Boiling Point: 537.5±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.4 mmHg at 25°C
Enthalpy of Vaporization: 81.4±3.0 kJ/mol
Flash Point: 278.9±32.9 °C
Index of Refraction: 1.598
Molar Refractivity: 97.7±0.5 cm3
#H bond acceptors: 7
#H bond donors: 1
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 0
ACD/LogP: 4.23
ACD/LogD (pH 5.5): 3.52
ACD/BCF (pH 5.5): 279.53
ACD/KOC (pH 5.5): 1962.12
ACD/LogD (pH 7.4): 3.52
ACD/BCF (pH 7.4): 275.07
ACD/KOC (pH 7.4): 1930.84
Polar Surface Area: 94 Å2
Polarizability: 38.7±0.5 10-24cm3
Surface Tension: 48.4±7.0 dyne/cm
Molar Volume: 286.4±7.0 cm3

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