ChemSpider 2D Image | Methyl 4-[({(2Z)-5-(acetoxymethyl)-2-[(2,5-diethoxyphenyl)imino]-8-methyl-2H-pyrano[2,3-c]pyridin-3-yl}carbonyl)amino]benzoate | C31H31N3O8

Methyl 4-[({(2Z)-5-(acetoxymethyl)-2-[(2,5-diethoxyphenyl)imino]-8-methyl-2H-pyrano[2,3-c]pyridin-3-yl}carbonyl)amino]benzoate

  • Molecular FormulaC31H31N3O8
  • Average mass573.593 Da
  • Monoisotopic mass573.211121 Da
  • ChemSpider ID23015718

  • Double-bond stereo - Double-bond stereo

More details:

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

4-[({(2Z)-5-(Acétoxyméthyl)-2-[(2,5-diéthoxyphényl)imino]-8-méthyl-2H-pyrano[2,3-c]pyridin-3-yl}carbonyl)amino]benzoate de méthyle [French] [ACD/IUPAC Name]
Benzoic acid, 4-[[[(2Z)-5-[(acetyloxy)methyl]-2-[(2,5-diethoxyphenyl)imino]-8-methyl-2H-pyrano[2,3-c]pyridin-3-yl]carbonyl]amino]-, methyl ester [ACD/Index Name]
Methyl 4-[({(2Z)-5-(acetoxymethyl)-2-[(2,5-diethoxyphenyl)imino]-8-methyl-2H-pyrano[2,3-c]pyridin-3-yl}carbonyl)amino]benzoate [ACD/IUPAC Name]
Methyl-4-[({(2Z)-5-(acetoxymethyl)-2-[(2,5-diethoxyphenyl)imino]-8-methyl-2H-pyrano[2,3-c]pyridin-3-yl}carbonyl)amino]benzoat [German] [ACD/IUPAC 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:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.594
Molar Refractivity: 153.0±0.5 cm3
#H bond acceptors: 11
#H bond donors: 1
#Freely Rotating Bonds: 12
#Rule of 5 Violations: 3
ACD/LogP: 7.07
ACD/LogD (pH 5.5): 5.47
ACD/BCF (pH 5.5): 8463.95
ACD/KOC (pH 5.5): 22533.86
ACD/LogD (pH 7.4): 5.47
ACD/BCF (pH 7.4): 8470.06
ACD/KOC (pH 7.4): 22550.15
Polar Surface Area: 135 Å2
Polarizability: 60.6±0.5 10-24cm3
Surface Tension: 44.9±7.0 dyne/cm
Molar Volume: 450.7±7.0 cm3

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