ChemSpider 2D Image | N-Ethyl-N-[(3,4,5-trichloro-2-pyridinyl)carbonyl]-beta-alanine | C11H11Cl3N2O3

N-Ethyl-N-[(3,4,5-trichloro-2-pyridinyl)carbonyl]-β-alanine

  • Molecular FormulaC11H11Cl3N2O3
  • Average mass325.576 Da
  • Monoisotopic mass323.983521 Da
  • ChemSpider ID26432617

More details:






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

N-Ethyl-N-[(3,4,5-trichlor-2-pyridinyl)carbonyl]-β-alanin [German] [ACD/IUPAC Name]
N-Ethyl-N-[(3,4,5-trichloro-2-pyridinyl)carbonyl]-β-alanine [ACD/IUPAC Name]
N-Éthyl-N-[(3,4,5-trichloro-2-pyridinyl)carbonyl]-β-alanine [French] [ACD/IUPAC Name]
β-Alanine, N-ethyl-N-[(3,4,5-trichloro-2-pyridinyl)carbonyl]- [ACD/Index Name]
3-[N-ethyl(3,4,5-trichloropyridin-2-yl)formamido]propanoic acid

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

Density: 1.5±0.1 g/cm3
Boiling Point: 529.9±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 84.7±3.0 kJ/mol
Flash Point: 274.3±30.1 °C
Index of Refraction: 1.583
Molar Refractivity: 72.9±0.3 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 2.66
ACD/LogD (pH 5.5): 1.14
ACD/BCF (pH 5.5): 1.94
ACD/KOC (pH 5.5): 21.65
ACD/LogD (pH 7.4): -0.61
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 71 Å2
Polarizability: 28.9±0.5 10-24cm3
Surface Tension: 57.8±3.0 dyne/cm
Molar Volume: 217.9±3.0 cm3

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