ChemSpider 2D Image | 3-Amino-3-(2-hydroxy-3,5-diiodophenyl)propanoic acid | C9H9I2NO3

3-Amino-3-(2-hydroxy-3,5-diiodophenyl)propanoic acid

  • Molecular FormulaC9H9I2NO3
  • Average mass432.982 Da
  • Monoisotopic mass432.867157 Da
  • ChemSpider ID26283656

More details:






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

3-Amino-3-(2-hydroxy-3,5-diiodophenyl)propanoic acid [ACD/IUPAC Name]
3-Amino-3-(2-hydroxy-3,5-diiodphenyl)propansäure [German] [ACD/IUPAC Name]
Acide 3-amino-3-(2-hydroxy-3,5-diiodophényl)propanoïque [French] [ACD/IUPAC Name]
Benzenepropanoic acid, β-amino-2-hydroxy-3,5-diiodo- [ACD/Index Name]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 2.4±0.1 g/cm3
Boiling Point: 451.6±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 74.9±3.0 kJ/mol
Flash Point: 226.9±28.7 °C
Index of Refraction: 1.747
Molar Refractivity: 73.2±0.3 cm3
#H bond acceptors: 4
#H bond donors: 4
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 2.32
ACD/LogD (pH 5.5): -0.21
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.32
ACD/LogD (pH 7.4): -0.61
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 84 Å2
Polarizability: 29.0±0.5 10-24cm3
Surface Tension: 79.9±3.0 dyne/cm
Molar Volume: 180.4±3.0 cm3

Click to predict properties on the Chemicalize site






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