ChemSpider 2D Image | Diethyl [(4-ethoxy-2,4-dioxobutyl)(4-sulfamoylphenyl)amino]malonate | C19H26N2O9S

Diethyl [(4-ethoxy-2,4-dioxobutyl)(4-sulfamoylphenyl)amino]malonate

  • Molecular FormulaC19H26N2O9S
  • Average mass458.483 Da
  • Monoisotopic mass458.135895 Da
  • ChemSpider ID102777153

More details:

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

[(4-Éthoxy-2,4-dioxobutyl)(4-sulfamoylphényl)amino]malonate de diéthyle [French] [ACD/IUPAC Name]
Diethyl [(4-ethoxy-2,4-dioxobutyl)(4-sulfamoylphenyl)amino]malonate [ACD/IUPAC Name]
Diethyl-[(4-ethoxy-2,4-dioxobutyl)(4-sulfamoylphenyl)amino]malonat [German] [ACD/IUPAC Name]
Propanedioic acid, 2-[[4-(aminosulfonyl)phenyl](4-ethoxy-2,4-dioxobutyl)amino]-, diethyl ester [ACD/Index Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 608.9±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.7 mmHg at 25°C
Enthalpy of Vaporization: 90.5±3.0 kJ/mol
Flash Point: 322.0±34.3 °C
Index of Refraction: 1.542
Molar Refractivity: 108.9±0.4 cm3
#H bond acceptors: 11
#H bond donors: 2
#Freely Rotating Bonds: 15
#Rule of 5 Violations: 1
ACD/LogP: 3.13
ACD/LogD (pH 5.5): 1.99
ACD/BCF (pH 5.5): 19.23
ACD/KOC (pH 5.5): 288.83
ACD/LogD (pH 7.4): 1.99
ACD/BCF (pH 7.4): 19.17
ACD/KOC (pH 7.4): 287.89
Polar Surface Area: 168 Å2
Polarizability: 43.2±0.5 10-24cm3
Surface Tension: 54.1±3.0 dyne/cm
Molar Volume: 345.9±3.0 cm3

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