ChemSpider 2D Image | Diethyl 4-[4-(2-methyl-2-propanyl)phenyl]-2,6-pyridinedicarboxylate | C21H25NO4

Diethyl 4-[4-(2-methyl-2-propanyl)phenyl]-2,6-pyridinedicarboxylate

  • Molecular FormulaC21H25NO4
  • Average mass355.427 Da
  • Monoisotopic mass355.178345 Da
  • ChemSpider ID21124667

More details:

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

2,6-Pyridinedicarboxylic acid, 4-[4-(1,1-dimethylethyl)phenyl]-, diethyl ester [ACD/Index Name]
4-[4-(2-Méthyl-2-propanyl)phényl]-2,6-pyridinedicarboxylate de diéthyle [French] [ACD/IUPAC Name]
Diethyl 4-[4-(2-methyl-2-propanyl)phenyl]-2,6-pyridinedicarboxylate [ACD/IUPAC Name]
Diethyl-4-[4-(2-methyl-2-propanyl)phenyl]-2,6-pyridindicarboxylat [German] [ACD/IUPAC Name]

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

Density: 1.1±0.1 g/cm3
Boiling Point: 497.1±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 76.5±3.0 kJ/mol
Flash Point: 254.5±28.7 °C
Index of Refraction: 1.531
Molar Refractivity: 100.1±0.3 cm3
#H bond acceptors: 5
#H bond donors: 0
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 1
ACD/LogP: 5.17
ACD/LogD (pH 5.5): 5.10
ACD/BCF (pH 5.5): 4403.94
ACD/KOC (pH 5.5): 14120.65
ACD/LogD (pH 7.4): 5.10
ACD/BCF (pH 7.4): 4403.94
ACD/KOC (pH 7.4): 14120.67
Polar Surface Area: 65 Å2
Polarizability: 39.7±0.5 10-24cm3
Surface Tension: 39.7±3.0 dyne/cm
Molar Volume: 323.4±3.0 cm3

Click to predict properties on the Chemicalize site


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