ChemSpider 2D Image | 4-[(4-Methoxybenzyl)(4-nitrobenzoyl)amino]benzoic acid | C22H18N2O6

4-[(4-Methoxybenzyl)(4-nitrobenzoyl)amino]benzoic acid

  • Molecular FormulaC22H18N2O6
  • Average mass406.388 Da
  • Monoisotopic mass406.116486 Da
  • ChemSpider ID21156823

More details:

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

4-[(4-Methoxybenzyl)(4-nitrobenzoyl)amino]benzoesäure [German] [ACD/IUPAC Name]
4-[(4-Methoxybenzyl)(4-nitrobenzoyl)amino]benzoic acid [ACD/IUPAC Name]
Acide 4-[(4-méthoxybenzyl)(4-nitrobenzoyl)amino]benzoïque [French] [ACD/IUPAC Name]
Benzoic acid, 4-[[(4-methoxyphenyl)methyl](4-nitrobenzoyl)amino]- [ACD/Index Name]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 659.0±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.1 mmHg at 25°C
Enthalpy of Vaporization: 101.9±3.0 kJ/mol
Flash Point: 352.4±31.5 °C
Index of Refraction: 1.667
Molar Refractivity: 110.2±0.3 cm3
#H bond acceptors: 8
#H bond donors: 1
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 4.00
ACD/LogD (pH 5.5): 2.90
ACD/BCF (pH 5.5): 46.20
ACD/KOC (pH 5.5): 232.04
ACD/LogD (pH 7.4): 1.33
ACD/BCF (pH 7.4): 1.25
ACD/KOC (pH 7.4): 6.26
Polar Surface Area: 113 Å2
Polarizability: 43.7±0.5 10-24cm3
Surface Tension: 63.8±3.0 dyne/cm
Molar Volume: 295.9±3.0 cm3

Click to predict properties on the Chemicalize site


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