ChemSpider 2D Image | Ethyl 4-(2-bromo-5-sulfamoylbenzoyl)-1-piperazinecarboxylate | C14H18BrN3O5S

Ethyl 4-(2-bromo-5-sulfamoylbenzoyl)-1-piperazinecarboxylate

  • Molecular FormulaC14H18BrN3O5S
  • Average mass420.279 Da
  • Monoisotopic mass419.015045 Da
  • ChemSpider ID32903004

More details:

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

1-Piperazinecarboxylic acid, 4-[5-(aminosulfonyl)-2-bromobenzoyl]-, ethyl ester [ACD/Index Name]
4-(2-Bromo-5-sulfamoylbenzoyl)-1-pipérazinecarboxylate d'éthyle [French] [ACD/IUPAC Name]
Ethyl 4-(2-bromo-5-sulfamoylbenzoyl)-1-piperazinecarboxylate [ACD/IUPAC Name]
Ethyl-4-(2-brom-5-sulfamoylbenzoyl)-1-piperazincarboxylat [German] [ACD/IUPAC Name]

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

Density: 1.6±0.1 g/cm3
Boiling Point: 614.7±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.8 mmHg at 25°C
Enthalpy of Vaporization: 91.2±3.0 kJ/mol
Flash Point: 325.6±34.3 °C
Index of Refraction: 1.609
Molar Refractivity: 91.6±0.4 cm3
#H bond acceptors: 8
#H bond donors: 2
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: -0.52
ACD/LogD (pH 5.5): 0.51
ACD/BCF (pH 5.5): 1.43
ACD/KOC (pH 5.5): 45.07
ACD/LogD (pH 7.4): 0.51
ACD/BCF (pH 7.4): 1.43
ACD/KOC (pH 7.4): 44.85
Polar Surface Area: 118 Å2
Polarizability: 36.3±0.5 10-24cm3
Surface Tension: 59.9±3.0 dyne/cm
Molar Volume: 264.8±3.0 cm3

Click to predict properties on the Chemicalize site


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