ChemSpider 2D Image | Methyl 5-[(4-amino-3,5-dichlorophenyl)sulfamoyl]-2-bromobenzoate | C14H11BrCl2N2O4S

Methyl 5-[(4-amino-3,5-dichlorophenyl)sulfamoyl]-2-bromobenzoate

  • Molecular FormulaC14H11BrCl2N2O4S
  • Average mass454.123 Da
  • Monoisotopic mass451.899994 Da
  • ChemSpider ID31657031

More details:






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

5-[(4-Amino-3,5-dichlorophényl)sulfamoyl]-2-bromobenzoate de méthyle [French] [ACD/IUPAC Name]
Benzoic acid, 5-[[(4-amino-3,5-dichlorophenyl)amino]sulfonyl]-2-bromo-, methyl ester [ACD/Index Name]
Methyl 5-[(4-amino-3,5-dichlorophenyl)sulfamoyl]-2-bromobenzoate [ACD/IUPAC Name]
Methyl-5-[(4-amino-3,5-dichlorphenyl)sulfamoyl]-2-brombenzoat [German] [ACD/IUPAC Name]

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

Density: 1.8±0.1 g/cm3
Boiling Point: 553.5±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 83.4±3.0 kJ/mol
Flash Point: 288.6±32.9 °C
Index of Refraction: 1.664
Molar Refractivity: 96.0±0.4 cm3
#H bond acceptors: 6
#H bond donors: 3
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 4.72
ACD/LogD (pH 5.5): 3.97
ACD/BCF (pH 5.5): 605.71
ACD/KOC (pH 5.5): 3339.26
ACD/LogD (pH 7.4): 3.16
ACD/BCF (pH 7.4): 93.84
ACD/KOC (pH 7.4): 517.35
Polar Surface Area: 107 Å2
Polarizability: 38.1±0.5 10-24cm3
Surface Tension: 67.7±3.0 dyne/cm
Molar Volume: 258.8±3.0 cm3

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