ChemSpider 2D Image | 2-{[1-(2,4-Dichlorophenyl)ethyl]amino}-2-oxoethyl 3,4,5-trimethoxybenzoate | C20H21Cl2NO6

2-{[1-(2,4-Dichlorophenyl)ethyl]amino}-2-oxoethyl 3,4,5-trimethoxybenzoate

  • Molecular FormulaC20H21Cl2NO6
  • Average mass442.290 Da
  • Monoisotopic mass441.074585 Da
  • ChemSpider ID21983220

More details:

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

2-{[1-(2,4-Dichlorophenyl)ethyl]amino}-2-oxoethyl 3,4,5-trimethoxybenzoate [ACD/IUPAC Name]
2-{[1-(2,4-Dichlorphenyl)ethyl]amino}-2-oxoethyl-3,4,5-trimethoxybenzoat [German] [ACD/IUPAC Name]
3,4,5-Triméthoxybenzoate de 2-{[1-(2,4-dichlorophényl)éthyl]amino}-2-oxoéthyle [French] [ACD/IUPAC Name]
Benzoic acid, 3,4,5-trimethoxy-, 2-[[1-(2,4-dichlorophenyl)ethyl]amino]-2-oxoethyl ester [ACD/Index Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 569.1±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.6 mmHg at 25°C
Enthalpy of Vaporization: 85.4±3.0 kJ/mol
Flash Point: 298.0±30.1 °C
Index of Refraction: 1.559
Molar Refractivity: 109.9±0.3 cm3
#H bond acceptors: 7
#H bond donors: 1
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 0
ACD/LogP: 3.85
ACD/LogD (pH 5.5): 3.80
ACD/BCF (pH 5.5): 452.58
ACD/KOC (pH 5.5): 2770.44
ACD/LogD (pH 7.4): 3.80
ACD/BCF (pH 7.4): 452.57
ACD/KOC (pH 7.4): 2770.42
Polar Surface Area: 83 Å2
Polarizability: 43.6±0.5 10-24cm3
Surface Tension: 44.2±3.0 dyne/cm
Molar Volume: 340.1±3.0 cm3

Click to predict properties on the Chemicalize site


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