ChemSpider 2D Image | 2-(4-Sulfamoylphenoxy)ethyl 2-[(methylsulfonyl)amino]benzoate | C16H18N2O7S2

2-(4-Sulfamoylphenoxy)ethyl 2-[(methylsulfonyl)amino]benzoate

  • Molecular FormulaC16H18N2O7S2
  • Average mass414.453 Da
  • Monoisotopic mass414.055542 Da
  • ChemSpider ID22065032

More details:

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

2-(4-Sulfamoylphenoxy)ethyl 2-[(methylsulfonyl)amino]benzoate [ACD/IUPAC Name]
2-(4-Sulfamoylphenoxy)ethyl-2-[(methylsulfonyl)amino]benzoat [German] [ACD/IUPAC Name]
2-[(Méthylsulfonyl)amino]benzoate de 2-(4-sulfamoylphénoxy)éthyle [French] [ACD/IUPAC Name]
Benzoic acid, 2-[(methylsulfonyl)amino]-, 2-[4-(aminosulfonyl)phenoxy]ethyl ester [ACD/Index Name]

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

Density: 1.5±0.1 g/cm3
Boiling Point: 651.5±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.0 mmHg at 25°C
Enthalpy of Vaporization: 96.0±3.0 kJ/mol
Flash Point: 347.8±34.3 °C
Index of Refraction: 1.616
Molar Refractivity: 98.5±0.4 cm3
#H bond acceptors: 9
#H bond donors: 3
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 0
ACD/LogP: 1.74
ACD/LogD (pH 5.5): 1.59
ACD/BCF (pH 5.5): 9.47
ACD/KOC (pH 5.5): 173.58
ACD/LogD (pH 7.4): 1.38
ACD/BCF (pH 7.4): 5.81
ACD/KOC (pH 7.4): 106.49
Polar Surface Area: 159 Å2
Polarizability: 39.0±0.5 10-24cm3
Surface Tension: 64.2±3.0 dyne/cm
Molar Volume: 281.7±3.0 cm3

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