ChemSpider 2D Image | 2-Methyl-2-propanyl 4-({[4-(4-amino-2-fluorophenoxy)-6-methoxy-7-quinolinyl]oxy}methyl)-1-piperidinecarboxylate | C27H32FN3O5

2-Methyl-2-propanyl 4-({[4-(4-amino-2-fluorophenoxy)-6-methoxy-7-quinolinyl]oxy}methyl)-1-piperidinecarboxylate

  • Molecular FormulaC27H32FN3O5
  • Average mass497.559 Da
  • Monoisotopic mass497.232605 Da
  • ChemSpider ID58941877

More details:

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

1-Piperidinecarboxylic acid, 4-[[[4-(4-amino-2-fluorophenoxy)-6-methoxy-7-quinolinyl]oxy]methyl]-, 1,1-dimethylethyl ester [ACD/Index Name]
2-Methyl-2-propanyl 4-({[4-(4-amino-2-fluorophenoxy)-6-methoxy-7-quinolinyl]oxy}methyl)-1-piperidinecarboxylate [ACD/IUPAC Name]
2-Methyl-2-propanyl-4-({[4-(4-amino-2-fluorphenoxy)-6-methoxy-7-chinolinyl]oxy}methyl)-1-piperidincarboxylat [German] [ACD/IUPAC Name]
4-({[4-(4-Amino-2-fluorophénoxy)-6-méthoxy-7-quinoléinyl]oxy}méthyl)-1-pipéridinecarboxylate de 2-méthyl-2-propanyle [French] [ACD/IUPAC Name]
929252-65-3 [RN]
BS-18001
MFCD26386170
tert-Butyl 4-(((4-(4-amino-2-fluorophenoxy)-6-methoxyquinolin-7-yl)oxy)methyl)piperidine-1-carboxylate
tert-butyl 4-({[4-(4-amino-2-fluorophenoxy)-6-methoxyquinolin-7-yl]oxy}methyl)piperidine-1-carboxylate

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

    Density: 1.2±0.1 g/cm3
    Boiling Point: 619.7±55.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.8 mmHg at 25°C
    Enthalpy of Vaporization: 91.8±3.0 kJ/mol
    Flash Point: 328.6±31.5 °C
    Index of Refraction: 1.589
    Molar Refractivity: 135.7±0.3 cm3
    #H bond acceptors: 8
    #H bond donors: 2
    #Freely Rotating Bonds: 8
    #Rule of 5 Violations: 0
    ACD/LogP: 4.72
    ACD/LogD (pH 5.5): 4.11
    ACD/BCF (pH 5.5): 683.57
    ACD/KOC (pH 5.5): 3173.72
    ACD/LogD (pH 7.4): 4.35
    ACD/BCF (pH 7.4): 1185.97
    ACD/KOC (pH 7.4): 5506.27
    Polar Surface Area: 96 Å2
    Polarizability: 53.8±0.5 10-24cm3
    Surface Tension: 49.5±3.0 dyne/cm
    Molar Volume: 402.6±3.0 cm3

    Click to predict properties on the Chemicalize site


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