ChemSpider 2D Image | 3-Chloro-N-(4-{[(3,5-dibromo-6-oxo-2,4-cyclohexadien-1-ylidene)methyl]amino}phenyl)benzamide | C20H13Br2ClN2O2

3-Chloro-N-(4-{[(3,5-dibromo-6-oxo-2,4-cyclohexadien-1-ylidene)methyl]amino}phenyl)benzamide

  • Molecular FormulaC20H13Br2ClN2O2
  • Average mass508.590 Da
  • Monoisotopic mass505.903229 Da
  • ChemSpider ID5232319

More details:

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

3-Chlor-N-(4-{[(3,5-dibrom-6-oxo-2,4-cyclohexadien-1-yliden)methyl]amino}phenyl)benzamid [German] [ACD/IUPAC Name]
3-Chloro-N-(4-{[(3,5-dibromo-6-oxo-2,4-cyclohexadien-1-ylidene)methyl]amino}phenyl)benzamide [ACD/IUPAC Name]
3-Chloro-N-(4-{[(3,5-dibromo-6-oxo-2,4-cyclohexadién-1-ylidène)méthyl]amino}phényl)benzamide [French] [ACD/IUPAC Name]
Benzamide, 3-chloro-N-[4-[[(3,5-dibromo-6-oxo-2,4-cyclohexadien-1-ylidene)methyl]amino]phenyl]- [ACD/Index Name]

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

Density: 1.9±0.1 g/cm3
Boiling Point: 471.6±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 73.4±3.0 kJ/mol
Flash Point: 239.0±28.7 °C
Index of Refraction: 1.821
Molar Refractivity: 117.5±0.3 cm3
#H bond acceptors: 4
#H bond donors: 2
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 1
ACD/LogP: 3.52
ACD/LogD (pH 5.5): 4.30
ACD/BCF (pH 5.5): 1093.53
ACD/KOC (pH 5.5): 5209.49
ACD/LogD (pH 7.4): 4.30
ACD/BCF (pH 7.4): 1093.53
ACD/KOC (pH 7.4): 5209.49
Polar Surface Area: 58 Å2
Polarizability: 46.6±0.5 10-24cm3
Surface Tension: 89.0±3.0 dyne/cm
Molar Volume: 269.6±3.0 cm3

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