ChemSpider 2D Image | Ethyl 2-{2-[4-(ethoxycarbonyl)-1-piperidinyl]-2-oxoethyl}-3-oxo-3,5,7,8-tetrahydropyrido[4,3-c]pyridazine-6(2H)-carboxylate | C20H28N4O6

Ethyl 2-{2-[4-(ethoxycarbonyl)-1-piperidinyl]-2-oxoethyl}-3-oxo-3,5,7,8-tetrahydropyrido[4,3-c]pyridazine-6(2H)-carboxylate

  • Molecular FormulaC20H28N4O6
  • Average mass420.460 Da
  • Monoisotopic mass420.200897 Da
  • ChemSpider ID26033722

More details:

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

2-{2-[4-(Éthoxycarbonyl)-1-pipéridinyl]-2-oxoéthyl}-3-oxo-3,5,7,8-tétrahydropyrido[4,3-c]pyridazine-6(2H)-carboxylate d'éthyle [French] [ACD/IUPAC Name]
Ethyl 2-{2-[4-(ethoxycarbonyl)-1-piperidinyl]-2-oxoethyl}-3-oxo-3,5,7,8-tetrahydropyrido[4,3-c]pyridazine-6(2H)-carboxylate [ACD/IUPAC Name]
Ethyl-2-{2-[4-(ethoxycarbonyl)-1-piperidinyl]-2-oxoethyl}-3-oxo-3,5,7,8-tetrahydropyrido[4,3-c]pyridazin-6(2H)-carboxylat [German] [ACD/IUPAC Name]
Pyrido[4,3-c]pyridazine-6(2H)-carboxylic acid, 2-[2-[4-(ethoxycarbonyl)-1-piperidinyl]-2-oxoethyl]-3,5,7,8-tetrahydro-3-oxo-, ethyl ester [ACD/Index Name]
2-[2-(4-Ethoxycarbonyl-piperidin-1-yl)-2-oxo-ethyl]-3-oxo-3,5,7,8-tetrahydro-2H-pyrido[4,3-c]pyridazine-6-carboxylic acid ethyl ester
ethyl 2-{2-[4-(ethoxycarbonyl)piperidin-1-yl]-2-oxoethyl}-3-oxo-3,5,7,8-tetrahydropyrido[4,3-c]pyridazine-6(2H)-carboxylate

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

Density: 1.4±0.1 g/cm3
Boiling Point: 600.0±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.7 mmHg at 25°C
Enthalpy of Vaporization: 89.3±3.0 kJ/mol
Flash Point: 316.7±34.3 °C
Index of Refraction: 1.622
Molar Refractivity: 107.8±0.5 cm3
#H bond acceptors: 10
#H bond donors: 0
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 1
ACD/LogP: 0.03
ACD/LogD (pH 5.5): 0.73
ACD/BCF (pH 5.5): 2.12
ACD/KOC (pH 5.5): 59.54
ACD/LogD (pH 7.4): 0.73
ACD/BCF (pH 7.4): 2.12
ACD/KOC (pH 7.4): 59.54
Polar Surface Area: 109 Å2
Polarizability: 42.7±0.5 10-24cm3
Surface Tension: 54.0±7.0 dyne/cm
Molar Volume: 306.3±7.0 cm3

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