ChemSpider 2D Image | 2-{[2-Chloro-5-(methoxycarbonyl)phenyl]amino}-2-oxoethyl 2,3,4-trimethoxybenzoate | C20H20ClNO8

2-{[2-Chloro-5-(methoxycarbonyl)phenyl]amino}-2-oxoethyl 2,3,4-trimethoxybenzoate

  • Molecular FormulaC20H20ClNO8
  • Average mass437.828 Da
  • Monoisotopic mass437.087738 Da
  • ChemSpider ID128500205

More details:

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

2,3,4-Triméthoxybenzoate de 2-{[2-chloro-5-(méthoxycarbonyl)phényl]amino}-2-oxoéthyle [French] [ACD/IUPAC Name]
2-{[2-Chlor-5-(methoxycarbonyl)phenyl]amino}-2-oxoethyl-2,3,4-trimethoxybenzoat [German] [ACD/IUPAC Name]
2-{[2-Chloro-5-(methoxycarbonyl)phenyl]amino}-2-oxoethyl 2,3,4-trimethoxybenzoate [ACD/IUPAC Name]
Benzoic acid, 2,3,4-trimethoxy-, 2-[[2-chloro-5-(methoxycarbonyl)phenyl]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: 633.8±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.9 mmHg at 25°C
Enthalpy of Vaporization: 93.7±3.0 kJ/mol
Flash Point: 337.1±31.5 °C
Index of Refraction: 1.579
Molar Refractivity: 108.6±0.3 cm3
#H bond acceptors: 9
#H bond donors: 1
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 0
ACD/LogP: 3.25
ACD/LogD (pH 5.5): 3.06
ACD/BCF (pH 5.5): 124.24
ACD/KOC (pH 5.5): 1098.19
ACD/LogD (pH 7.4): 3.06
ACD/BCF (pH 7.4): 124.21
ACD/KOC (pH 7.4): 1097.98
Polar Surface Area: 109 Å2
Polarizability: 43.0±0.5 10-24cm3
Surface Tension: 48.5±3.0 dyne/cm
Molar Volume: 326.6±3.0 cm3

Click to predict properties on the Chemicalize site


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