ChemSpider 2D Image | 2-{[2,6-Dimethyl-4-(2-methyl-2-propanyl)benzyl]sulfonyl}-N-(2-methoxyphenyl)propanamide | C23H31NO4S

2-{[2,6-Dimethyl-4-(2-methyl-2-propanyl)benzyl]sulfonyl}-N-(2-methoxyphenyl)propanamide

  • Molecular FormulaC23H31NO4S
  • Average mass417.561 Da
  • Monoisotopic mass417.197388 Da
  • ChemSpider ID30020276

More details:

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

2-{[2,6-Dimethyl-4-(2-methyl-2-propanyl)benzyl]sulfonyl}-N-(2-methoxyphenyl)propanamid [German] [ACD/IUPAC Name]
2-{[2,6-Dimethyl-4-(2-methyl-2-propanyl)benzyl]sulfonyl}-N-(2-methoxyphenyl)propanamide [ACD/IUPAC Name]
2-{[2,6-Diméthyl-4-(2-méthyl-2-propanyl)benzyl]sulfonyl}-N-(2-méthoxyphényl)propanamide [French] [ACD/IUPAC Name]
Propanamide, 2-[[[4-(1,1-dimethylethyl)-2,6-dimethylphenyl]methyl]sulfonyl]-N-(2-methoxyphenyl)- [ACD/Index 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: 607.4±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.7 mmHg at 25°C
Enthalpy of Vaporization: 90.3±3.0 kJ/mol
Flash Point: 321.1±31.5 °C
Index of Refraction: 1.560
Molar Refractivity: 116.7±0.4 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 1
ACD/LogP: 5.05
ACD/LogD (pH 5.5): 4.97
ACD/BCF (pH 5.5): 3511.18
ACD/KOC (pH 5.5): 12006.59
ACD/LogD (pH 7.4): 4.97
ACD/BCF (pH 7.4): 3511.38
ACD/KOC (pH 7.4): 12007.27
Polar Surface Area: 81 Å2
Polarizability: 46.3±0.5 10-24cm3
Surface Tension: 42.8±3.0 dyne/cm
Molar Volume: 360.9±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement