ChemSpider 2D Image | Diethyl 4-{2-chloro-4-[(1-ethoxy-1-oxo-2-propanyl)oxy]-5-methoxyphenyl}-2,6-dimethyl-1,4-dihydro-3,5-pyridinedicarboxylate | C25H32ClNO8

Diethyl 4-{2-chloro-4-[(1-ethoxy-1-oxo-2-propanyl)oxy]-5-methoxyphenyl}-2,6-dimethyl-1,4-dihydro-3,5-pyridinedicarboxylate

  • Molecular FormulaC25H32ClNO8
  • Average mass509.977 Da
  • Monoisotopic mass509.181641 Da
  • ChemSpider ID82770624

More details:

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

3,5-Pyridinedicarboxylic acid, 4-[2-chloro-4-(2-ethoxy-1-methyl-2-oxoethoxy)-5-methoxyphenyl]-1,4-dihydro-2,6-dimethyl-, diethyl ester [ACD/Index Name]
4-{2-Chloro-4-[(1-éthoxy-1-oxo-2-propanyl)oxy]-5-méthoxyphényl}-2,6-diméthyl-1,4-dihydro-3,5-pyridinedicarboxylate de diéthyle [French] [ACD/IUPAC Name]
Diethyl 4-{2-chloro-4-[(1-ethoxy-1-oxo-2-propanyl)oxy]-5-methoxyphenyl}-2,6-dimethyl-1,4-dihydro-3,5-pyridinedicarboxylate [ACD/IUPAC Name]
Diethyl-4-{2-chlor-4-[(1-ethoxy-1-oxo-2-propanyl)oxy]-5-methoxyphenyl}-2,6-dimethyl-1,4-dihydro-3,5-pyridindicarboxylat [German] [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: 576.3±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.6 mmHg at 25°C
Enthalpy of Vaporization: 86.3±3.0 kJ/mol
Flash Point: 302.3±30.1 °C
Index of Refraction: 1.522
Molar Refractivity: 129.1±0.3 cm3
#H bond acceptors: 9
#H bond donors: 1
#Freely Rotating Bonds: 13
#Rule of 5 Violations: 2
ACD/LogP: 5.11
ACD/LogD (pH 5.5): 4.61
ACD/BCF (pH 5.5): 1879.47
ACD/KOC (pH 5.5): 7671.76
ACD/LogD (pH 7.4): 4.61
ACD/BCF (pH 7.4): 1883.35
ACD/KOC (pH 7.4): 7687.57
Polar Surface Area: 109 Å2
Polarizability: 51.2±0.5 10-24cm3
Surface Tension: 40.9±3.0 dyne/cm
Molar Volume: 423.3±3.0 cm3

Click to predict properties on the Chemicalize site


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