ChemSpider 2D Image | 2-Methyl-2-propanyl 4-(2-{[4-(2,4-dichlorophenoxy)butanoyl]oxy}ethyl)-1-piperazinecarboxylate | C21H30Cl2N2O5

2-Methyl-2-propanyl 4-(2-{[4-(2,4-dichlorophenoxy)butanoyl]oxy}ethyl)-1-piperazinecarboxylate

  • Molecular FormulaC21H30Cl2N2O5
  • Average mass461.379 Da
  • Monoisotopic mass460.153168 Da
  • ChemSpider ID59110099

More details:

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

1-Piperazinecarboxylic acid, 4-[2-[4-(2,4-dichlorophenoxy)-1-oxobutoxy]ethyl]-, 1,1-dimethylethyl ester [ACD/Index Name]
2-Methyl-2-propanyl 4-(2-{[4-(2,4-dichlorophenoxy)butanoyl]oxy}ethyl)-1-piperazinecarboxylate [ACD/IUPAC Name]
2-Methyl-2-propanyl-4-(2-{[4-(2,4-dichlorphenoxy)butanoyl]oxy}ethyl)-1-piperazincarboxylat [German] [ACD/IUPAC Name]
4-(2-{[4-(2,4-Dichlorophénoxy)butanoyl]oxy}éthyl)-1-pipérazinecarboxylate de 2-méthyl-2-propanyle [French] [ACD/IUPAC Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 551.3±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 83.2±3.0 kJ/mol
Flash Point: 287.2±30.1 °C
Index of Refraction: 1.531
Molar Refractivity: 116.1±0.3 cm3
#H bond acceptors: 7
#H bond donors: 0
#Freely Rotating Bonds: 11
#Rule of 5 Violations: 0
ACD/LogP: 4.68
ACD/LogD (pH 5.5): 4.26
ACD/BCF (pH 5.5): 849.42
ACD/KOC (pH 5.5): 3487.42
ACD/LogD (pH 7.4): 4.59
ACD/BCF (pH 7.4): 1818.44
ACD/KOC (pH 7.4): 7465.85
Polar Surface Area: 68 Å2
Polarizability: 46.0±0.5 10-24cm3
Surface Tension: 44.7±3.0 dyne/cm
Molar Volume: 375.1±3.0 cm3

Click to predict properties on the Chemicalize site


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