ChemSpider 2D Image | 2-(2,6-Dimethyl-4-morpholinyl)-2-oxoethyl 4-(4-chloro-2-nitrophenoxy)-3-methoxybenzoate | C22H23ClN2O8

2-(2,6-Dimethyl-4-morpholinyl)-2-oxoethyl 4-(4-chloro-2-nitrophenoxy)-3-methoxybenzoate

  • Molecular FormulaC22H23ClN2O8
  • Average mass478.880 Da
  • Monoisotopic mass478.114288 Da
  • ChemSpider ID22302380

More details:






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

2-(2,6-Dimethyl-4-morpholinyl)-2-oxoethyl 4-(4-chloro-2-nitrophenoxy)-3-methoxybenzoate [ACD/IUPAC Name]
2-(2,6-Dimethyl-4-morpholinyl)-2-oxoethyl-4-(4-chlor-2-nitrophenoxy)-3-methoxybenzoat [German] [ACD/IUPAC Name]
4-(4-Chloro-2-nitrophénoxy)-3-méthoxybenzoate de 2-(2,6-diméthyl-4-morpholinyl)-2-oxoéthyle [French] [ACD/IUPAC Name]
Benzoic acid, 4-(4-chloro-2-nitrophenoxy)-3-methoxy-, 2-(2,6-dimethyl-4-morpholinyl)-2-oxoethyl ester [ACD/Index Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 636.0±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.9 mmHg at 25°C
Enthalpy of Vaporization: 94.0±3.0 kJ/mol
Flash Point: 338.4±31.5 °C
Index of Refraction: 1.569
Molar Refractivity: 118.1±0.3 cm3
#H bond acceptors: 10
#H bond donors: 0
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 1
ACD/LogP: 3.10
ACD/LogD (pH 5.5): 3.51
ACD/BCF (pH 5.5): 271.75
ACD/KOC (pH 5.5): 1923.03
ACD/LogD (pH 7.4): 3.51
ACD/BCF (pH 7.4): 271.75
ACD/KOC (pH 7.4): 1923.03
Polar Surface Area: 120 Å2
Polarizability: 46.8±0.5 10-24cm3
Surface Tension: 48.9±3.0 dyne/cm
Molar Volume: 360.5±3.0 cm3

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