ChemSpider 2D Image | 4-Methoxybenzyl 7-(2-furyl)-2-methyl-4-(3-nitrophenyl)-5-oxo-1,4,5,6,7,8-hexahydro-3-quinolinecarboxylate | C29H26N2O7

4-Methoxybenzyl 7-(2-furyl)-2-methyl-4-(3-nitrophenyl)-5-oxo-1,4,5,6,7,8-hexahydro-3-quinolinecarboxylate

  • Molecular FormulaC29H26N2O7
  • Average mass514.526 Da
  • Monoisotopic mass514.174011 Da
  • ChemSpider ID2222258

More details:

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

3-Quinolinecarboxylic acid, 7-(2-furanyl)-1,4,5,6,7,8-hexahydro-2-methyl-4-(3-nitrophenyl)-5-oxo-, (4-methoxyphenyl)methyl ester [ACD/Index Name]
4-Methoxybenzyl 7-(2-furyl)-2-methyl-4-(3-nitrophenyl)-5-oxo-1,4,5,6,7,8-hexahydro-3-quinolinecarboxylate [ACD/IUPAC Name]
4-Methoxybenzyl 7-(2-furyl)-2-methyl-4-(3-nitrophenyl)-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
4-Methoxybenzyl-7-(2-furyl)-2-methyl-4-(3-nitrophenyl)-5-oxo-1,4,5,6,7,8-hexahydro-3-chinolincarboxylat [German] [ACD/IUPAC Name]
7-(2-Furyl)-2-méthyl-4-(3-nitrophényl)-5-oxo-1,4,5,6,7,8-hexahydro-3-quinoléinecarboxylate de 4-méthoxybenzyle [French] [ACD/IUPAC Name]
(4-methoxyphenyl)methyl 7-(2-furyl)-2-methyl-4-(3-nitrophenyl)-5-oxo-1,4,6,7,8-pentahydroquinoline-3-carboxylate
4-methoxybenzyl 7-(furan-2-yl)-2-methyl-4-(3-nitrophenyl)-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate

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

Density: 1.4±0.1 g/cm3
Boiling Point: 678.6±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.1 mmHg at 25°C
Enthalpy of Vaporization: 99.6±3.0 kJ/mol
Flash Point: 364.2±31.5 °C
Index of Refraction: 1.648
Molar Refractivity: 137.0±0.4 cm3
#H bond acceptors: 9
#H bond donors: 1
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 1
ACD/LogP: 3.59
ACD/LogD (pH 5.5): 4.80
ACD/BCF (pH 5.5): 2622.83
ACD/KOC (pH 5.5): 9744.27
ACD/LogD (pH 7.4): 4.80
ACD/BCF (pH 7.4): 2622.86
ACD/KOC (pH 7.4): 9744.40
Polar Surface Area: 124 Å2
Polarizability: 54.3±0.5 10-24cm3
Surface Tension: 62.5±5.0 dyne/cm
Molar Volume: 376.7±5.0 cm3

Click to predict properties on the Chemicalize site


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