ChemSpider 2D Image | 2-[(2-{[4-Chloro-3-(trifluoromethyl)phenyl]amino}-2-oxoethyl)(methyl)amino]-2-oxoethyl 2-hydroxy-5-methoxybenzoate | C20H18ClF3N2O6

2-[(2-{[4-Chloro-3-(trifluoromethyl)phenyl]amino}-2-oxoethyl)(methyl)amino]-2-oxoethyl 2-hydroxy-5-methoxybenzoate

  • Molecular FormulaC20H18ClF3N2O6
  • Average mass474.815 Da
  • Monoisotopic mass474.080536 Da
  • ChemSpider ID34002765

More details:

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

2-[(2-{[4-Chlor-3-(trifluormethyl)phenyl]amino}-2-oxoethyl)(methyl)amino]-2-oxoethyl-2-hydroxy-5-methoxybenzoat [German] [ACD/IUPAC Name]
2-[(2-{[4-Chloro-3-(trifluoromethyl)phenyl]amino}-2-oxoethyl)(methyl)amino]-2-oxoethyl 2-hydroxy-5-methoxybenzoate [ACD/IUPAC Name]
2-Hydroxy-5-méthoxybenzoate de 2-[(2-{[4-chloro-3-(trifluorométhyl)phényl]amino}-2-oxoéthyl)(méthyl)amino]-2-oxoéthyle [French] [ACD/IUPAC Name]
Benzoic acid, 2-hydroxy-5-methoxy-, 2-[[2-[[4-chloro-3-(trifluoromethyl)phenyl]amino]-2-oxoethyl]methylamino]-2-oxoethyl ester [ACD/Index 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: 652.9±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.0 mmHg at 25°C
Enthalpy of Vaporization: 99.7±3.0 kJ/mol
Flash Point: 348.7±31.5 °C
Index of Refraction: 1.575
Molar Refractivity: 108.0±0.3 cm3
#H bond acceptors: 8
#H bond donors: 2
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 0
ACD/LogP: 4.04
ACD/LogD (pH 5.5): 4.16
ACD/BCF (pH 5.5): 848.71
ACD/KOC (pH 5.5): 4342.86
ACD/LogD (pH 7.4): 4.10
ACD/BCF (pH 7.4): 740.18
ACD/KOC (pH 7.4): 3787.50
Polar Surface Area: 105 Å2
Polarizability: 42.8±0.5 10-24cm3
Surface Tension: 49.5±3.0 dyne/cm
Molar Volume: 326.6±3.0 cm3

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