ChemSpider 2D Image | 4-{[3-(2,4-Dichlorobenzoyl)-2-(3-ethoxy-4-hydroxyphenyl)-4-hydroxy-5-oxo-2,5-dihydro-1H-pyrrol-1-yl]methyl}benzenesulfonamide | C26H22Cl2N2O7S

4-{[3-(2,4-Dichlorobenzoyl)-2-(3-ethoxy-4-hydroxyphenyl)-4-hydroxy-5-oxo-2,5-dihydro-1H-pyrrol-1-yl]methyl}benzenesulfonamide

  • Molecular FormulaC26H22Cl2N2O7S
  • Average mass577.433 Da
  • Monoisotopic mass576.052490 Da
  • ChemSpider ID117913342

More details:

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

4-{[3-(2,4-Dichlorbenzoyl)-2-(3-ethoxy-4-hydroxyphenyl)-4-hydroxy-5-oxo-2,5-dihydro-1H-pyrrol-1-yl]methyl}benzolsulfonamid [German] [ACD/IUPAC Name]
4-{[3-(2,4-Dichlorobenzoyl)-2-(3-ethoxy-4-hydroxyphenyl)-4-hydroxy-5-oxo-2,5-dihydro-1H-pyrrol-1-yl]methyl}benzenesulfonamide [ACD/IUPAC Name]
4-{[3-(2,4-Dichlorobenzoyl)-2-(3-éthoxy-4-hydroxyphényl)-4-hydroxy-5-oxo-2,5-dihydro-1H-pyrrol-1-yl]méthyl}benzènesulfonamide [French] [ACD/IUPAC Name]
Benzenesulfonamide, 4-[[3-(2,4-dichlorobenzoyl)-2-(3-ethoxy-4-hydroxyphenyl)-2,5-dihydro-4-hydroxy-5-oxo-1H-pyrrol-1-yl]methyl]- [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: 833.7±75.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.2 mmHg at 25°C
Enthalpy of Vaporization: 127.0±3.0 kJ/mol
Flash Point: 458.0±37.1 °C
Index of Refraction: 1.682
Molar Refractivity: 141.6±0.4 cm3
#H bond acceptors: 9
#H bond donors: 4
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 1
ACD/LogP: 3.15
ACD/LogD (pH 5.5): 1.91
ACD/BCF (pH 5.5): 9.39
ACD/KOC (pH 5.5): 87.54
ACD/LogD (pH 7.4): 0.14
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.50
Polar Surface Area: 156 Å2
Polarizability: 56.1±0.5 10-24cm3
Surface Tension: 72.2±3.0 dyne/cm
Molar Volume: 373.8±3.0 cm3

Click to predict properties on the Chemicalize site


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