ChemSpider 2D Image | 4-Chloro-N-[4-chloro-3-(3-chloro-5-cyanophenoxy)-2-fluorobenzyl]-2-(hydroxymethyl)-1H-imidazole-5-carboxamide | C19H12Cl3FN4O3

4-Chloro-N-[4-chloro-3-(3-chloro-5-cyanophenoxy)-2-fluorobenzyl]-2-(hydroxymethyl)-1H-imidazole-5-carboxamide

  • Molecular FormulaC19H12Cl3FN4O3
  • Average mass469.681 Da
  • Monoisotopic mass467.995911 Da
  • ChemSpider ID28664279

More details:






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

1H-Imidazole-5-carboxamide, 4-chloro-N-[[4-chloro-3-(3-chloro-5-cyanophenoxy)-2-fluorophenyl]methyl]-2-(hydroxymethyl)- [ACD/Index Name]
4-Chloranyl-N-[[4-Chloranyl-3-(3-Chloranyl-5-Cyano-Phenoxy)-2-Fluoranyl-Phenyl]methyl]-2-(Hydroxymethyl)-1h-Imidazole-5-Carboxamide
4-Chlor-N-[4-chlor-3-(3-chlor-5-cyanphenoxy)-2-fluorbenzyl]-2-(hydroxymethyl)-1H-imidazol-5-carboxamid [German] [ACD/IUPAC Name]
4-Chloro-N-[4-chloro-3-(3-chloro-5-cyanophenoxy)-2-fluorobenzyl]-2-(hydroxymethyl)-1H-imidazole-5-carboxamide [ACD/IUPAC Name]
4-Chloro-N-[4-chloro-3-(3-chloro-5-cyanophénoxy)-2-fluorobenzyl]-2-(hydroxyméthyl)-1H-imidazole-5-carboxamide [French] [ACD/IUPAC Name]
EUR

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

Density: 1.6±0.1 g/cm3
Boiling Point: 685.0±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.2 mmHg at 25°C
Enthalpy of Vaporization: 105.5±3.0 kJ/mol
Flash Point: 368.1±31.5 °C
Index of Refraction: 1.681
Molar Refractivity: 108.0±0.4 cm3
#H bond acceptors: 7
#H bond donors: 3
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 4.02
ACD/LogD (pH 5.5): 3.51
ACD/BCF (pH 5.5): 274.90
ACD/KOC (pH 5.5): 1937.64
ACD/LogD (pH 7.4): 3.44
ACD/BCF (pH 7.4): 231.69
ACD/KOC (pH 7.4): 1633.06
Polar Surface Area: 111 Å2
Polarizability: 42.8±0.5 10-24cm3
Surface Tension: 83.3±5.0 dyne/cm
Molar Volume: 285.3±5.0 cm3

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