ChemSpider 2D Image | N-[2-(Diethylamino)ethyl]-3-(trifluoromethyl)benzenesulfonamide | C13H19F3N2O2S

N-[2-(Diethylamino)ethyl]-3-(trifluoromethyl)benzenesulfonamide

  • Molecular FormulaC13H19F3N2O2S
  • Average mass324.362 Da
  • Monoisotopic mass324.111938 Da
  • ChemSpider ID31142986

More details:

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

Benzenesulfonamide, N-[2-(diethylamino)ethyl]-3-(trifluoromethyl)- [ACD/Index Name]
N-[2-(Diethylamino)ethyl]-3-(trifluormethyl)benzolsulfonamid [German] [ACD/IUPAC Name]
N-[2-(Diethylamino)ethyl]-3-(trifluoromethyl)benzenesulfonamide [ACD/IUPAC Name]
N-[2-(Diéthylamino)éthyl]-3-(trifluorométhyl)benzènesulfonamide [French] [ACD/IUPAC Name]
10.1021/jm400990p
Z5K

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

Density: 1.2±0.1 g/cm3
Boiling Point: 381.2±52.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.9 mmHg at 25°C
Enthalpy of Vaporization: 62.9±3.0 kJ/mol
Flash Point: 184.3±30.7 °C
Index of Refraction: 1.488
Molar Refractivity: 75.9±0.4 cm3
#H bond acceptors: 4
#H bond donors: 1
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 0
ACD/LogP: 3.09
ACD/LogD (pH 5.5): -0.42
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): 0.56
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 5.50
Polar Surface Area: 58 Å2
Polarizability: 30.1±0.5 10-24cm3
Surface Tension: 35.0±3.0 dyne/cm
Molar Volume: 263.3±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement