ChemSpider 2D Image | Diethyl [(4-ethoxy-4-oxobutyl)(4-hydroxy-3-nitrophenyl)amino]malonate | C19H26N2O9

Diethyl [(4-ethoxy-4-oxobutyl)(4-hydroxy-3-nitrophenyl)amino]malonate

  • Molecular FormulaC19H26N2O9
  • Average mass426.418 Da
  • Monoisotopic mass426.163818 Da
  • ChemSpider ID102819680

More details:

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

[(4-Éthoxy-4-oxobutyl)(4-hydroxy-3-nitrophényl)amino]malonate de diéthyle [French] [ACD/IUPAC Name]
Diethyl [(4-ethoxy-4-oxobutyl)(4-hydroxy-3-nitrophenyl)amino]malonate [ACD/IUPAC Name]
Diethyl-[(4-ethoxy-4-oxobutyl)(4-hydroxy-3-nitrophenyl)amino]malonat [German] [ACD/IUPAC Name]
Propanedioic acid, 2-[(4-ethoxy-4-oxobutyl)(4-hydroxy-3-nitrophenyl)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: 553.7±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.6 mmHg at 25°C
Enthalpy of Vaporization: 86.6±3.0 kJ/mol
Flash Point: 288.7±30.1 °C
Index of Refraction: 1.551
Molar Refractivity: 105.2±0.3 cm3
#H bond acceptors: 11
#H bond donors: 1
#Freely Rotating Bonds: 15
#Rule of 5 Violations: 1
ACD/LogP: 4.00
ACD/LogD (pH 5.5): 3.13
ACD/BCF (pH 5.5): 139.80
ACD/KOC (pH 5.5): 1182.24
ACD/LogD (pH 7.4): 2.54
ACD/BCF (pH 7.4): 35.94
ACD/KOC (pH 7.4): 303.92
Polar Surface Area: 148 Å2
Polarizability: 41.7±0.5 10-24cm3
Surface Tension: 52.6±3.0 dyne/cm
Molar Volume: 330.1±3.0 cm3

Click to predict properties on the Chemicalize site


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