ChemSpider 2D Image | N-(1-Hexyn-1-yl)-4-methyl-N-(3-octyn-1-yl)benzenesulfonamide | C21H29NO2S

N-(1-Hexyn-1-yl)-4-methyl-N-(3-octyn-1-yl)benzenesulfonamide

  • Molecular FormulaC21H29NO2S
  • Average mass359.526 Da
  • Monoisotopic mass359.191895 Da
  • ChemSpider ID29272425

More details:






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

Benzenesulfonamide, N-1-hexyn-1-yl-4-methyl-N-3-octyn-1-yl- [ACD/Index Name]
N-(1-Hexin-1-yl)-4-methyl-N-(3-octin-1-yl)benzolsulfonamid [German] [ACD/IUPAC Name]
N-(1-Hexyn-1-yl)-4-methyl-N-(3-octyn-1-yl)benzenesulfonamide [ACD/IUPAC Name]
N-(1-Hexyn-1-yl)-4-méthyl-N-(3-octyn-1-yl)benzènesulfonamide [French] [ACD/IUPAC Name]
N-(Hex-1-yn-1-yl)-4-methyl-N-(oct-3-yn-1-yl)benzenesulfonamide

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

Density: 1.1±0.1 g/cm3
Boiling Point: 485.9±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 75.1±3.0 kJ/mol
Flash Point: 247.7±31.5 °C
Index of Refraction: 1.537
Molar Refractivity: 104.9±0.4 cm3
#H bond acceptors: 3
#H bond donors: 0
#Freely Rotating Bonds: 12
#Rule of 5 Violations: 1
ACD/LogP: 7.12
ACD/LogD (pH 5.5): 5.97
ACD/BCF (pH 5.5): 20194.27
ACD/KOC (pH 5.5): 42001.87
ACD/LogD (pH 7.4): 5.97
ACD/BCF (pH 7.4): 20194.27
ACD/KOC (pH 7.4): 42001.87
Polar Surface Area: 46 Å2
Polarizability: 41.6±0.5 10-24cm3
Surface Tension: 43.7±3.0 dyne/cm
Molar Volume: 335.9±3.0 cm3

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