ChemSpider 2D Image | N-(2,4-Dibromo-6-{[cyclohexyl(methyl)amino]methyl}phenyl)-4-hydroxy-3-methoxybenzamide | C22H26Br2N2O3

N-(2,4-Dibromo-6-{[cyclohexyl(methyl)amino]methyl}phenyl)-4-hydroxy-3-methoxybenzamide

  • Molecular FormulaC22H26Br2N2O3
  • Average mass526.261 Da
  • Monoisotopic mass524.031006 Da
  • ChemSpider ID118773

More details:






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

Benzamide, N-[2,4-dibromo-6-[(cyclohexylmethylamino)methyl]phenyl]-4-hydroxy-3-methoxy- [ACD/Index Name]
N-(2,4-Dibrom-6-{[cyclohexyl(methyl)amino]methyl}phenyl)-4-hydroxy-3-methoxybenzamid [German] [ACD/IUPAC Name]
N-(2,4-Dibromo-6-{[cyclohexyl(methyl)amino]methyl}phenyl)-4-hydroxy-3-methoxybenzamide [ACD/IUPAC Name]
N-(2,4-Dibromo-6-{[cyclohexyl(méthyl)amino]méthyl}phényl)-4-hydroxy-3-méthoxybenzamide [French] [ACD/IUPAC Name]
84461-99-4 [RN]
Benzamide, N-(2,4-dibromo-6-((cyclohexylmethylamino)methyl)phenyl)-4-hydroxy-3-methoxy-
N-(2,4-Dibromo-6-((cyclohexylmethylamino)methyl)phenyl)-4-hydroxy-3-methoxybenzamide

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

BR 227 [DBID]
BR-227 [DBID]

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

Density: 1.6±0.1 g/cm3
Boiling Point: 547.5±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 85.8±3.0 kJ/mol
Flash Point: 284.9±30.1 °C
Index of Refraction: 1.652
Molar Refractivity: 122.1±0.4 cm3
#H bond acceptors: 5
#H bond donors: 2
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 2
ACD/LogP: 5.77
ACD/LogD (pH 5.5): 2.60
ACD/BCF (pH 5.5): 13.77
ACD/KOC (pH 5.5): 43.57
ACD/LogD (pH 7.4): 4.21
ACD/BCF (pH 7.4): 558.83
ACD/KOC (pH 7.4): 1768.42
Polar Surface Area: 62 Å2
Polarizability: 48.4±0.5 10-24cm3
Surface Tension: 63.0±5.0 dyne/cm
Molar Volume: 333.8±5.0 cm3

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