ChemSpider 2D Image | Ethyl 4-[(Z)-(2,4-dinitrophenoxy)-NNO-azoxy]-2,6-dimethyl-1-piperazinecarboxylate | C15H20N6O8

Ethyl 4-[(Z)-(2,4-dinitrophenoxy)-NNO-azoxy]-2,6-dimethyl-1-piperazinecarboxylate

  • Molecular FormulaC15H20N6O8
  • Average mass412.355 Da
  • Monoisotopic mass412.134247 Da
  • ChemSpider ID24687469

  • Double-bond stereo - Double-bond stereo

More details:

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

1-Piperazinecarboxylic acid, 4-[(Z)-(2,4-dinitrophenoxy)-NNO-azoxy]-2,6-dimethyl-, ethyl ester [ACD/Index Name]
4-[(Z)-(2,4-Dinitrophénoxy)-NNO-azoxy]-2,6-diméthyl-1-pipérazinecarboxylate d'éthyle [French] [ACD/IUPAC Name]
Ethyl 4-[(Z)-(2,4-dinitrophenoxy)-NNO-azoxy]-2,6-dimethyl-1-piperazinecarboxylate [ACD/IUPAC Name]
Ethyl-4-[(Z)-(2,4-dinitrophenoxy)-NNO-azoxy]-2,6-dimethyl-1-piperazincarboxylat [German] [ACD/IUPAC Name]
https://www.ebi.ac.uk/chembl/compoundreportcard/CHEMBL446313/

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

Density: 1.5±0.1 g/cm3
Boiling Point: 548.6±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 82.8±3.0 kJ/mol
Flash Point: 285.6±32.9 °C
Index of Refraction: 1.637
Molar Refractivity: 96.7±0.5 cm3
#H bond acceptors: 14
#H bond donors: 0
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 1
ACD/LogP: 3.27
ACD/LogD (pH 5.5):
ACD/BCF (pH 5.5):
ACD/KOC (pH 5.5):
ACD/LogD (pH 7.4):
ACD/BCF (pH 7.4):
ACD/KOC (pH 7.4):
Polar Surface Area: 175 Å2
Polarizability: 38.4±0.5 10-24cm3
Surface Tension: 64.5±7.0 dyne/cm
Molar Volume: 269.7±7.0 cm3

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