ChemSpider 2D Image | N-(3-Chloro-4-fluorophenyl)-4-{[(4-methoxy-3-nitrophenyl)carbamoyl]amino}benzamide | C21H16ClFN4O5

N-(3-Chloro-4-fluorophenyl)-4-{[(4-methoxy-3-nitrophenyl)carbamoyl]amino}benzamide

  • Molecular FormulaC21H16ClFN4O5
  • Average mass458.827 Da
  • Monoisotopic mass458.079315 Da
  • ChemSpider ID59427911

More details:

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

Benzamide, N-(3-chloro-4-fluorophenyl)-4-[[[(4-methoxy-3-nitrophenyl)amino]carbonyl]amino]- [ACD/Index Name]
N-(3-Chlor-4-fluorphenyl)-4-{[(4-methoxy-3-nitrophenyl)carbamoyl]amino}benzamid [German] [ACD/IUPAC Name]
N-(3-Chloro-4-fluorophenyl)-4-{[(4-methoxy-3-nitrophenyl)carbamoyl]amino}benzamide [ACD/IUPAC Name]
N-(3-Chloro-4-fluorophényl)-4-{[(4-méthoxy-3-nitrophényl)carbamoyl]amino}benzamide [French] [ACD/IUPAC Name]

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

Density: 1.5±0.1 g/cm3
Boiling Point: 491.2±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 75.8±3.0 kJ/mol
Flash Point: 250.9±28.7 °C
Index of Refraction: 1.712
Molar Refractivity: 117.8±0.3 cm3
#H bond acceptors: 9
#H bond donors: 3
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 1
ACD/LogP: 5.59
ACD/LogD (pH 5.5): 5.04
ACD/BCF (pH 5.5): 3988.20
ACD/KOC (pH 5.5): 13153.14
ACD/LogD (pH 7.4): 5.04
ACD/BCF (pH 7.4): 3987.74
ACD/KOC (pH 7.4): 13151.66
Polar Surface Area: 125 Å2
Polarizability: 46.7±0.5 10-24cm3
Surface Tension: 66.9±3.0 dyne/cm
Molar Volume: 300.7±3.0 cm3

Click to predict properties on the Chemicalize site


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