ChemSpider 2D Image | Ethyl 3-[(6-{[(3,5-dichlorophenyl)amino]methyl}-1-[2-(2-hydroxyethoxy)ethyl]-4-oxo-1,4-dihydro-3-pyridinyl)oxy]propanoate | C21H26Cl2N2O6

Ethyl 3-[(6-{[(3,5-dichlorophenyl)amino]methyl}-1-[2-(2-hydroxyethoxy)ethyl]-4-oxo-1,4-dihydro-3-pyridinyl)oxy]propanoate

  • Molecular FormulaC21H26Cl2N2O6
  • Average mass473.347 Da
  • Monoisotopic mass472.116791 Da
  • ChemSpider ID123703962

More details:

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

3-[(6-{[(3,5-Dichlorophényl)amino]méthyl}-1-[2-(2-hydroxyéthoxy)éthyl]-4-oxo-1,4-dihydro-3-pyridinyl)oxy]propanoate d'éthyle [French] [ACD/IUPAC Name]
Ethyl 3-[(6-{[(3,5-dichlorophenyl)amino]methyl}-1-[2-(2-hydroxyethoxy)ethyl]-4-oxo-1,4-dihydro-3-pyridinyl)oxy]propanoate [ACD/IUPAC Name]
Ethyl-3-[(6-{[(3,5-dichlorphenyl)amino]methyl}-1-[2-(2-hydroxyethoxy)ethyl]-4-oxo-1,4-dihydro-3-pyridinyl)oxy]propanoat [German] [ACD/IUPAC Name]
Propanoic acid, 3-[[6-[[(3,5-dichlorophenyl)amino]methyl]-1,4-dihydro-1-[2-(2-hydroxyethoxy)ethyl]-4-oxo-3-pyridinyl]oxy]-, ethyl ester [ACD/Index Name]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 668.5±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.1 mmHg at 25°C
Enthalpy of Vaporization: 103.2±3.0 kJ/mol
Flash Point: 358.1±31.5 °C
Index of Refraction: 1.592
Molar Refractivity: 117.7±0.4 cm3
#H bond acceptors: 8
#H bond donors: 2
#Freely Rotating Bonds: 14
#Rule of 5 Violations: 0
ACD/LogP: 3.09
ACD/LogD (pH 5.5): 3.26
ACD/BCF (pH 5.5): 177.41
ACD/KOC (pH 5.5): 1415.64
ACD/LogD (pH 7.4): 3.26
ACD/BCF (pH 7.4): 178.09
ACD/KOC (pH 7.4): 1421.04
Polar Surface Area: 97 Å2
Polarizability: 46.7±0.5 10-24cm3
Surface Tension: 58.0±5.0 dyne/cm
Molar Volume: 348.0±5.0 cm3

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