ChemSpider 2D Image | N-(~2~H_9_)Butylbenzenesulfonamide | C10H6D9NO2S

N-(2H9)Butylbenzenesulfonamide

  • Molecular FormulaC10H6D9NO2S
  • Average mass222.352 Da
  • Monoisotopic mass222.138840 Da
  • ChemSpider ID58779116
  • Non-standard isotope - Non-standard isotope


More details:






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

Benzenesulfonamide, N-(butyl-d9)- [ACD/Index Name]
N-(2H9)Butylbenzenesulfonamide [ACD/IUPAC Name]
N-(2H9)Butylbenzènesulfonamide [French] [ACD/IUPAC Name]
N-(2H9)Butylbenzolsulfonamid [German] [ACD/IUPAC Name]
3622-84-2 [RN]

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

Density: 1.1±0.1 g/cm3
Boiling Point: 326.7±25.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.7 mmHg at 25°C
Enthalpy of Vaporization: 56.9±3.0 kJ/mol
Flash Point: 151.4±23.2 °C
Index of Refraction: 1.521
Molar Refractivity: 57.7±0.4 cm3
#H bond acceptors: 3
#H bond donors: 1
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 2.57
ACD/LogD (pH 5.5): 1.85
ACD/BCF (pH 5.5): 14.92
ACD/KOC (pH 5.5): 240.87
ACD/LogD (pH 7.4): 1.85
ACD/BCF (pH 7.4): 14.92
ACD/KOC (pH 7.4): 240.86
Polar Surface Area: 55 Å2
Polarizability: 22.9±0.5 10-24cm3
Surface Tension: 38.4±3.0 dyne/cm
Molar Volume: 189.5±3.0 cm3

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