ChemSpider 2D Image | Methyl 4-chloro-6-benzyloxy-quinoline-2-carboxylate | C18H14ClNO3

Methyl 4-chloro-6-benzyloxy-quinoline-2-carboxylate

  • Molecular FormulaC18H14ClNO3
  • Average mass327.762 Da
  • Monoisotopic mass327.066223 Da
  • ChemSpider ID21513487

More details:

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

2-Quinolinecarboxylic acid, 4-chloro-6-(phenylmethoxy)-, methyl ester [ACD/Index Name]
6-(Benzyloxy)-4-chloro-2-quinoléinecarboxylate de méthyle [French] [ACD/IUPAC Name]
905807-66-1 [RN]
Methyl 4-chloro-6-benzyloxy-quinoline-2-carboxylate
Methyl 6-(benzyloxy)-4-chloro-2-quinolinecarboxylate [ACD/IUPAC Name]
Methyl 6-(benzyloxy)-4-chloroquinoline-2-carboxylate
Methyl-6-(benzyloxy)-4-chlor-2-chinolincarboxylat [German] [ACD/IUPAC Name]
6-Benzyloxy-4-chloro-quinoline-2-carboxylic acid methyl ester
DS-18930
METHYL 4-CHLORO-6-BENZYLOXYQUINOLINE-2-CARBOXYLATE
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Validated by Experts, Validated by Users, Non-Validated, Removed by Users

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

    Density: 1.3±0.1 g/cm3
    Boiling Point: 483.8±40.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.2 mmHg at 25°C
    Enthalpy of Vaporization: 74.9±3.0 kJ/mol
    Flash Point: 246.4±27.3 °C
    Index of Refraction: 1.635
    Molar Refractivity: 90.0±0.3 cm3
    #H bond acceptors: 4
    #H bond donors: 0
    #Freely Rotating Bonds: 5
    #Rule of 5 Violations: 0
    ACD/LogP: 4.87
    ACD/LogD (pH 5.5): 4.99
    ACD/BCF (pH 5.5): 3681.84
    ACD/KOC (pH 5.5): 12421.74
    ACD/LogD (pH 7.4): 4.99
    ACD/BCF (pH 7.4): 3681.88
    ACD/KOC (pH 7.4): 12421.88
    Polar Surface Area: 48 Å2
    Polarizability: 35.7±0.5 10-24cm3
    Surface Tension: 52.0±3.0 dyne/cm
    Molar Volume: 251.3±3.0 cm3

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