ChemSpider 2D Image | N-(4-Chloro-2-fluorobenzyl)-N-(3-ethoxypropyl)-4-isopropoxybenzenesulfonamide | C21H27ClFNO4S

N-(4-Chloro-2-fluorobenzyl)-N-(3-ethoxypropyl)-4-isopropoxybenzenesulfonamide

  • Molecular FormulaC21H27ClFNO4S
  • Average mass443.960 Da
  • Monoisotopic mass443.133331 Da
  • ChemSpider ID59147669

More details:

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

Benzenesulfonamide, N-[(4-chloro-2-fluorophenyl)methyl]-N-(3-ethoxypropyl)-4-(1-methylethoxy)- [ACD/Index Name]
N-(4-Chlor-2-fluorbenzyl)-N-(3-ethoxypropyl)-4-isopropoxybenzolsulfonamid [German] [ACD/IUPAC Name]
N-(4-Chloro-2-fluorobenzyl)-N-(3-ethoxypropyl)-4-isopropoxybenzenesulfonamide [ACD/IUPAC Name]
N-(4-Chloro-2-fluorobenzyl)-N-(3-éthoxypropyl)-4-isopropoxybenzènesulfonamide [French] [ACD/IUPAC Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 542.4±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.4 mmHg at 25°C
Enthalpy of Vaporization: 82.1±3.0 kJ/mol
Flash Point: 281.8±32.9 °C
Index of Refraction: 1.544
Molar Refractivity: 114.2±0.4 cm3
#H bond acceptors: 5
#H bond donors: 0
#Freely Rotating Bonds: 11
#Rule of 5 Violations: 1
ACD/LogP: 5.74
ACD/LogD (pH 5.5): 5.47
ACD/BCF (pH 5.5): 8376.26
ACD/KOC (pH 5.5): 22372.24
ACD/LogD (pH 7.4): 5.47
ACD/BCF (pH 7.4): 8376.26
ACD/KOC (pH 7.4): 22372.24
Polar Surface Area: 64 Å2
Polarizability: 45.3±0.5 10-24cm3
Surface Tension: 42.9±3.0 dyne/cm
Molar Volume: 361.6±3.0 cm3

Click to predict properties on the Chemicalize site


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