ChemSpider 2D Image | [{2-Oxo-2-[(2,4,6-trichlorophenyl)amino]ethyl}(propyl)amino]acetic acid | C13H15Cl3N2O3

[{2-Oxo-2-[(2,4,6-trichlorophenyl)amino]ethyl}(propyl)amino]acetic acid

  • Molecular FormulaC13H15Cl3N2O3
  • Average mass353.629 Da
  • Monoisotopic mass352.014832 Da
  • ChemSpider ID26431786

More details:

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

[{2-Oxo-2-[(2,4,6-trichlorophenyl)amino]ethyl}(propyl)amino]acetic acid [ACD/IUPAC Name]
[{2-Oxo-2-[(2,4,6-trichlorphenyl)amino]ethyl}(propyl)amino]essigsäure [German] [ACD/IUPAC Name]
Acetic acid, 2-[[2-oxo-2-[(2,4,6-trichlorophenyl)amino]ethyl]propylamino]- [ACD/Index Name]
Acide [{2-oxo-2-[(2,4,6-trichlorophényl)amino]éthyl}(propyl)amino]acétique [French] [ACD/IUPAC Name]
2-[propyl({[(2,4,6-trichlorophenyl)carbamoyl]methyl})amino]acetic acid

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

Density: 1.5±0.1 g/cm3
Boiling Point: 522.3±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.4 mmHg at 25°C
Enthalpy of Vaporization: 83.8±3.0 kJ/mol
Flash Point: 269.7±30.1 °C
Index of Refraction: 1.605
Molar Refractivity: 83.7±0.3 cm3
#H bond acceptors: 5
#H bond donors: 2
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 3.01
ACD/LogD (pH 5.5): 0.40
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 3.47
ACD/LogD (pH 7.4): -0.24
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 70 Å2
Polarizability: 33.2±0.5 10-24cm3
Surface Tension: 56.3±3.0 dyne/cm
Molar Volume: 242.8±3.0 cm3

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