ChemSpider 2D Image | Methyl 2-[(E)-2-(dimethylamino)vinyl]-5-oxo-6-phenyl-5,6-dihydro-1,6-naphthyridine-3-carboxylate | C20H19N3O3

Methyl 2-[(E)-2-(dimethylamino)vinyl]-5-oxo-6-phenyl-5,6-dihydro-1,6-naphthyridine-3-carboxylate

  • Molecular FormulaC20H19N3O3
  • Average mass349.383 Da
  • Monoisotopic mass349.142639 Da
  • ChemSpider ID28611814

  • Double-bond stereo - Double-bond stereo

More details:

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

1,6-Naphthyridine-3-carboxylic acid, 2-[(E)-2-(dimethylamino)ethenyl]-5,6-dihydro-5-oxo-6-phenyl-, methyl ester [ACD/Index Name]
2-[(E)-2-(Diméthylamino)vinyl]-5-oxo-6-phényl-5,6-dihydro-1,6-naphtyridine-3-carboxylate de méthyle [French] [ACD/IUPAC Name]
Methyl 2-[(E)-2-(dimethylamino)vinyl]-5-oxo-6-phenyl-5,6-dihydro-1,6-naphthyridine-3-carboxylate [ACD/IUPAC Name]
Methyl-2-[(E)-2-(dimethylamino)vinyl]-5-oxo-6-phenyl-5,6-dihydro-1,6-naphthyridin-3-carboxylat [German] [ACD/IUPAC Name]
1374510-87-8 [RN]
methyl 2-[(E)-2-(dimethylamino)ethenyl]-5-oxo-6-phenyl-1,6-naphthyridine-3-carboxylate
MFCD22374886 [MDL number]

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

    Density: 1.3±0.1 g/cm3
    Boiling Point: 579.5±50.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.6 mmHg at 25°C
    Enthalpy of Vaporization: 86.7±3.0 kJ/mol
    Flash Point: 304.3±30.1 °C
    Index of Refraction: 1.643
    Molar Refractivity: 100.3±0.3 cm3
    #H bond acceptors: 6
    #H bond donors: 0
    #Freely Rotating Bonds: 5
    #Rule of 5 Violations: 0
    ACD/LogP: 3.13
    ACD/LogD (pH 5.5): 1.93
    ACD/BCF (pH 5.5): 11.27
    ACD/KOC (pH 5.5): 119.49
    ACD/LogD (pH 7.4): 2.67
    ACD/BCF (pH 7.4): 61.63
    ACD/KOC (pH 7.4): 653.34
    Polar Surface Area: 63 Å2
    Polarizability: 39.8±0.5 10-24cm3
    Surface Tension: 55.7±3.0 dyne/cm
    Molar Volume: 277.2±3.0 cm3

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