ChemSpider 2D Image | 1-(3-Hydroxypropyl)-2-{[(4-iodophenyl)amino]methyl}-5-(2-phenylethoxy)-4(1H)-pyridinone | C23H25IN2O3

1-(3-Hydroxypropyl)-2-{[(4-iodophenyl)amino]methyl}-5-(2-phenylethoxy)-4(1H)-pyridinone

  • Molecular FormulaC23H25IN2O3
  • Average mass504.361 Da
  • Monoisotopic mass504.090973 Da
  • ChemSpider ID124242816

More details:

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

1-(3-Hydroxypropyl)-2-{[(4-iodophenyl)amino]methyl}-5-(2-phenylethoxy)-4(1H)-pyridinone [ACD/IUPAC Name]
1-(3-Hydroxypropyl)-2-{[(4-iodophényl)amino]méthyl}-5-(2-phényléthoxy)-4(1H)-pyridinone [French] [ACD/IUPAC Name]
1-(3-Hydroxypropyl)-2-{[(4-iodphenyl)amino]methyl}-5-(2-phenylethoxy)-4(1H)-pyridinon [German] [ACD/IUPAC Name]
4(1H)-Pyridinone, 1-(3-hydroxypropyl)-2-[[(4-iodophenyl)amino]methyl]-5-(2-phenylethoxy)- [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: 654.6±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.1 mmHg at 25°C
Enthalpy of Vaporization: 101.3±3.0 kJ/mol
Flash Point: 349.7±31.5 °C
Index of Refraction: 1.670
Molar Refractivity: 123.6±0.4 cm3
#H bond acceptors: 5
#H bond donors: 2
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 1
ACD/LogP: 3.92
ACD/LogD (pH 5.5): 3.77
ACD/BCF (pH 5.5): 433.34
ACD/KOC (pH 5.5): 2673.98
ACD/LogD (pH 7.4): 3.78
ACD/BCF (pH 7.4): 439.95
ACD/KOC (pH 7.4): 2714.73
Polar Surface Area: 62 Å2
Polarizability: 49.0±0.5 10-24cm3
Surface Tension: 61.7±5.0 dyne/cm
Molar Volume: 330.9±5.0 cm3

Click to predict properties on the Chemicalize site


Advertisement