ChemSpider 2D Image | 4-{[(2-Iodo-5-methoxyphenyl)carbamoyl]amino}butanoic acid | C12H15IN2O4

4-{[(2-Iodo-5-methoxyphenyl)carbamoyl]amino}butanoic acid

  • Molecular FormulaC12H15IN2O4
  • Average mass378.163 Da
  • Monoisotopic mass378.007629 Da
  • ChemSpider ID57968611

More details:

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

4-{[(2-Iod-5-methoxyphenyl)carbamoyl]amino}butansäure [German] [ACD/IUPAC Name]
4-{[(2-Iodo-5-methoxyphenyl)carbamoyl]amino}butanoic acid [ACD/IUPAC Name]
Acide 4-{[(2-iodo-5-méthoxyphényl)carbamoyl]amino}butanoïque [French] [ACD/IUPAC Name]
Butanoic acid, 4-[[[(2-iodo-5-methoxyphenyl)amino]carbonyl]amino]- [ACD/Index Name]

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

Density: 1.7±0.1 g/cm3
Boiling Point: 485.6±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 79.1±3.0 kJ/mol
Flash Point: 247.5±28.7 °C
Index of Refraction: 1.633
Molar Refractivity: 79.2±0.3 cm3
#H bond acceptors: 6
#H bond donors: 3
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 2.52
ACD/LogD (pH 5.5): 1.44
ACD/BCF (pH 5.5): 4.31
ACD/KOC (pH 5.5): 52.77
ACD/LogD (pH 7.4): -0.36
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 88 Å2
Polarizability: 31.4±0.5 10-24cm3
Surface Tension: 58.4±3.0 dyne/cm
Molar Volume: 221.6±3.0 cm3

Click to predict properties on the Chemicalize site


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