ChemSpider 2D Image | tert-Butyl 4-(5-(ethoxycarbonyl)pyridin-2-yl)piperazine-1-carboxylate | C17H25N3O4

tert-Butyl 4-(5-(ethoxycarbonyl)pyridin-2-yl)piperazine-1-carboxylate

  • Molecular FormulaC17H25N3O4
  • Average mass335.398 Da
  • Monoisotopic mass335.184509 Da
  • ChemSpider ID28595296

More details:

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

1-Piperazinecarboxylic acid, 4-[5-(ethoxycarbonyl)-2-pyridinyl]-, 1,1-dimethylethyl ester [ACD/Index Name]
201809-20-3 [RN]
2-Methyl-2-propanyl 4-[5-(ethoxycarbonyl)-2-pyridinyl]-1-piperazinecarboxylate [ACD/IUPAC Name]
2-Methyl-2-propanyl-4-[5-(ethoxycarbonyl)-2-pyridinyl]-1-piperazincarboxylat [German] [ACD/IUPAC Name]
4-[5-(Éthoxycarbonyl)-2-pyridinyl]-1-pipérazinecarboxylate de 2-méthyl-2-propanyle [French] [ACD/IUPAC Name]
tert-Butyl 4-(5-(ethoxycarbonyl)pyridin-2-yl)piperazine-1-carboxylate
tert-Butyl 4-[5-(ethoxycarbonyl)pyridin-2-yl]piperazine-1-carboxylate
[201809-20-3] [RN]
1-PIPERAZINECARBOXYLICACID, 4-[5-(ETHOXYCARBONYL)-2-PYRIDINYL]-,1,1-DIMETHYLETHYL ESTER
1-Piperazinecarboxylicacid,4-[5-(ethoxycarbonyl)-2-pyridinyl]-,1,1-dimethylethyl ester
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Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.2±0.1 g/cm3
Boiling Point: 470.7±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 73.3±3.0 kJ/mol
Flash Point: 238.5±28.7 °C
Index of Refraction: 1.534
Molar Refractivity: 89.3±0.3 cm3
#H bond acceptors: 7
#H bond donors: 0
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 2.03
ACD/LogD (pH 5.5): 1.88
ACD/BCF (pH 5.5): 9.24
ACD/KOC (pH 5.5): 89.65
ACD/LogD (pH 7.4): 2.83
ACD/BCF (pH 7.4): 80.57
ACD/KOC (pH 7.4): 781.44
Polar Surface Area: 72 Å2
Polarizability: 35.4±0.5 10-24cm3
Surface Tension: 45.9±3.0 dyne/cm
Molar Volume: 287.6±3.0 cm3

Click to predict properties on the Chemicalize site


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