ChemSpider 2D Image | 2-{[(4-Iodophenyl)amino]methyl}-5-[(3-methylbenzyl)oxy]-1-propyl-4(1H)-pyridinone | C23H25IN2O2

2-{[(4-Iodophenyl)amino]methyl}-5-[(3-methylbenzyl)oxy]-1-propyl-4(1H)-pyridinone

  • Molecular FormulaC23H25IN2O2
  • Average mass488.361 Da
  • Monoisotopic mass488.096069 Da
  • ChemSpider ID123842924

More details:

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

2-{[(4-Iodophenyl)amino]methyl}-5-[(3-methylbenzyl)oxy]-1-propyl-4(1H)-pyridinone [ACD/IUPAC Name]
2-{[(4-Iodophényl)amino]méthyl}-5-[(3-méthylbenzyl)oxy]-1-propyl-4(1H)-pyridinone [French] [ACD/IUPAC Name]
2-{[(4-Iodphenyl)amino]methyl}-5-[(3-methylbenzyl)oxy]-1-propyl-4(1H)-pyridinon [German] [ACD/IUPAC Name]
4(1H)-Pyridinone, 2-[[(4-iodophenyl)amino]methyl]-5-[(3-methylphenyl)methoxy]-1-propyl- [ACD/Index Name]

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

Density: 1.5±0.1 g/cm3
Boiling Point: 604.7±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.7 mmHg at 25°C
Enthalpy of Vaporization: 89.9±3.0 kJ/mol
Flash Point: 319.5±31.5 °C
Index of Refraction: 1.653
Molar Refractivity: 122.0±0.4 cm3
#H bond acceptors: 4
#H bond donors: 1
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 1
ACD/LogP: 5.81
ACD/LogD (pH 5.5): 4.95
ACD/BCF (pH 5.5): 3359.91
ACD/KOC (pH 5.5): 11583.45
ACD/LogD (pH 7.4): 4.95
ACD/BCF (pH 7.4): 3411.40
ACD/KOC (pH 7.4): 11760.98
Polar Surface Area: 42 Å2
Polarizability: 48.4±0.5 10-24cm3
Surface Tension: 55.3±5.0 dyne/cm
Molar Volume: 333.2±5.0 cm3

Click to predict properties on the Chemicalize site


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