ChemSpider 2D Image | N-[2-(2-Chloro-6-fluorophenyl)-2-(2-methyl-4-morpholinyl)ethyl]-3-cyano-4-fluorobenzenesulfonamide | C20H20ClF2N3O3S

N-[2-(2-Chloro-6-fluorophenyl)-2-(2-methyl-4-morpholinyl)ethyl]-3-cyano-4-fluorobenzenesulfonamide

  • Molecular FormulaC20H20ClF2N3O3S
  • Average mass455.906 Da
  • Monoisotopic mass455.088196 Da
  • ChemSpider ID31828803

More details:

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

Benzenesulfonamide, N-[2-(2-chloro-6-fluorophenyl)-2-(2-methyl-4-morpholinyl)ethyl]-3-cyano-4-fluoro- [ACD/Index Name]
N-[2-(2-Chlor-6-fluorphenyl)-2-(2-methyl-4-morpholinyl)ethyl]-3-cyan-4-fluorbenzolsulfonamid [German] [ACD/IUPAC Name]
N-[2-(2-Chloro-6-fluorophenyl)-2-(2-methyl-4-morpholinyl)ethyl]-3-cyano-4-fluorobenzenesulfonamide [ACD/IUPAC Name]
N-[2-(2-Chloro-6-fluorophényl)-2-(2-méthyl-4-morpholinyl)éthyl]-3-cyano-4-fluorobenzènesulfonamide [French] [ACD/IUPAC 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: 566.5±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.6 mmHg at 25°C
Enthalpy of Vaporization: 85.1±3.0 kJ/mol
Flash Point: 296.4±32.9 °C
Index of Refraction: 1.610
Molar Refractivity: 109.5±0.4 cm3
#H bond acceptors: 6
#H bond donors: 1
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 3.07
ACD/LogD (pH 5.5): 3.33
ACD/BCF (pH 5.5): 196.35
ACD/KOC (pH 5.5): 1490.93
ACD/LogD (pH 7.4): 3.36
ACD/BCF (pH 7.4): 210.75
ACD/KOC (pH 7.4): 1600.31
Polar Surface Area: 91 Å2
Polarizability: 43.4±0.5 10-24cm3
Surface Tension: 59.9±5.0 dyne/cm
Molar Volume: 315.8±5.0 cm3

Click to predict properties on the Chemicalize site


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