ChemSpider 2D Image | 4-(2,2-Difluoroethoxy)-N-[(1-methyl-1H-pyrazol-4-yl)methyl]benzenesulfonamide | C13H15F2N3O3S

4-(2,2-Difluoroethoxy)-N-[(1-methyl-1H-pyrazol-4-yl)methyl]benzenesulfonamide

  • Molecular FormulaC13H15F2N3O3S
  • Average mass331.338 Da
  • Monoisotopic mass331.080231 Da
  • ChemSpider ID30429520

More details:

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

4-(2,2-Difluorethoxy)-N-[(1-methyl-1H-pyrazol-4-yl)methyl]benzolsulfonamid [German] [ACD/IUPAC Name]
4-(2,2-Difluoroethoxy)-N-[(1-methyl-1H-pyrazol-4-yl)methyl]benzenesulfonamide [ACD/IUPAC Name]
4-(2,2-Difluoroéthoxy)-N-[(1-méthyl-1H-pyrazol-4-yl)méthyl]benzènesulfonamide [French] [ACD/IUPAC Name]
Benzenesulfonamide, 4-(2,2-difluoroethoxy)-N-[(1-methyl-1H-pyrazol-4-yl)methyl]- [ACD/Index Name]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 491.2±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 75.8±3.0 kJ/mol
Flash Point: 250.8±31.5 °C
Index of Refraction: 1.574
Molar Refractivity: 78.1±0.5 cm3
#H bond acceptors: 6
#H bond donors: 1
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 1.52
ACD/LogD (pH 5.5): 1.98
ACD/BCF (pH 5.5): 18.98
ACD/KOC (pH 5.5): 286.10
ACD/LogD (pH 7.4): 1.98
ACD/BCF (pH 7.4): 18.96
ACD/KOC (pH 7.4): 285.87
Polar Surface Area: 82 Å2
Polarizability: 31.0±0.5 10-24cm3
Surface Tension: 45.0±7.0 dyne/cm
Molar Volume: 236.8±7.0 cm3

Click to predict properties on the Chemicalize site


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