ChemSpider 2D Image | Ethyl 2-{[(2Z)-3-(3,4,5-trimethoxyphenyl)-2-propenoyl]amino}benzoate | C21H23NO6

Ethyl 2-{[(2Z)-3-(3,4,5-trimethoxyphenyl)-2-propenoyl]amino}benzoate

  • Molecular FormulaC21H23NO6
  • Average mass385.410 Da
  • Monoisotopic mass385.152527 Da
  • ChemSpider ID128530694

  • Double-bond stereo - Double-bond stereo

More details:

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

2-{[(2Z)-3-(3,4,5-Triméthoxyphényl)-2-propenoyl]amino}benzoate d'éthyle [French] [ACD/IUPAC Name]
Benzoic acid, 2-[[(2Z)-1-oxo-3-(3,4,5-trimethoxyphenyl)-2-propen-1-yl]amino]-, ethyl ester [ACD/Index Name]
Ethyl 2-{[(2Z)-3-(3,4,5-trimethoxyphenyl)-2-propenoyl]amino}benzoate [ACD/IUPAC Name]
Ethyl-2-{[(2Z)-3-(3,4,5-trimethoxyphenyl)-2-propenoyl]amino}benzoat [German] [ACD/IUPAC Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 585.7±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.6 mmHg at 25°C
Enthalpy of Vaporization: 87.5±3.0 kJ/mol
Flash Point: 308.0±30.1 °C
Index of Refraction: 1.594
Molar Refractivity: 107.8±0.3 cm3
#H bond acceptors: 7
#H bond donors: 1
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 0
ACD/LogP: 4.95
ACD/LogD (pH 5.5): 3.60
ACD/BCF (pH 5.5): 319.12
ACD/KOC (pH 5.5): 2157.42
ACD/LogD (pH 7.4): 3.60
ACD/BCF (pH 7.4): 319.12
ACD/KOC (pH 7.4): 2157.40
Polar Surface Area: 83 Å2
Polarizability: 42.7±0.5 10-24cm3
Surface Tension: 45.2±3.0 dyne/cm
Molar Volume: 317.8±3.0 cm3

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