ChemSpider 2D Image | Propyl 7-(3,4-dimethoxyphenyl)-4-(4-ethoxy-3-methoxyphenyl)-2-methyl-5-oxo-1,4,5,6,7,8-hexahydro-3-quinolinecarboxylate | C31H37NO7

Propyl 7-(3,4-dimethoxyphenyl)-4-(4-ethoxy-3-methoxyphenyl)-2-methyl-5-oxo-1,4,5,6,7,8-hexahydro-3-quinolinecarboxylate

  • Molecular FormulaC31H37NO7
  • Average mass535.628 Da
  • Monoisotopic mass535.257019 Da
  • ChemSpider ID2385775

More details:

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

3-Quinolinecarboxylic acid, 7-(3,4-dimethoxyphenyl)-4-(4-ethoxy-3-methoxyphenyl)-1,4,5,6,7,8-hexahydro-2-methyl-5-oxo-, propyl ester [ACD/Index Name]
7-(3,4-Diméthoxyphényl)-4-(4-éthoxy-3-méthoxyphényl)-2-méthyl-5-oxo-1,4,5,6,7,8-hexahydro-3-quinoléinecarboxylate de propyle [French] [ACD/IUPAC Name]
Propyl 7-(3,4-dimethoxyphenyl)-4-(4-ethoxy-3-methoxyphenyl)-2-methyl-5-oxo-1,4,5,6,7,8-hexahydro-3-quinolinecarboxylate [ACD/IUPAC Name]
Propyl-7-(3,4-dimethoxyphenyl)-4-(4-ethoxy-3-methoxyphenyl)-2-methyl-5-oxo-1,4,5,6,7,8-hexahydro-3-chinolincarboxylat [German] [ACD/IUPAC Name]
421572-94-3 [RN]
7-(3,4-Dimethoxy-phenyl)-4-(4-ethoxy-3-methoxy-phenyl)-2-methyl-5-oxo-1,4,5,6,7,8-hexahydro-quinoline-3-carboxylic acid propyl ester
AC1MJ7KZ
AGN-PC-05W9HR
HMS612F22
MolPort-000-906-000
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Validated by Experts, Validated by Users, Non-Validated, Removed by Users

AG-690/40749855 [DBID]
BAS 01547857 [DBID]
ChemDiv1_008932 [DBID]

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

    Density: 1.2±0.1 g/cm3
    Boiling Point: 655.1±55.0 °C at 760 mmHg
    Vapour Pressure: 0.0±2.0 mmHg at 25°C
    Enthalpy of Vaporization: 96.5±3.0 kJ/mol
    Flash Point: 350.0±31.5 °C
    Index of Refraction: 1.585
    Molar Refractivity: 146.8±0.4 cm3
    #H bond acceptors: 8
    #H bond donors: 1
    #Freely Rotating Bonds: 11
    #Rule of 5 Violations: 1
    ACD/LogP: 4.38
    ACD/LogD (pH 5.5): 4.57
    ACD/BCF (pH 5.5): 1739.35
    ACD/KOC (pH 5.5): 7262.11
    ACD/LogD (pH 7.4): 4.57
    ACD/BCF (pH 7.4): 1739.39
    ACD/KOC (pH 7.4): 7262.29
    Polar Surface Area: 92 Å2
    Polarizability: 58.2±0.5 10-24cm3
    Surface Tension: 50.8±5.0 dyne/cm
    Molar Volume: 437.9±5.0 cm3

    Click to predict properties on the Chemicalize site


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