ChemSpider 2D Image | Methyl 8-bromo-5-quinolinecarboxylate | C11H8BrNO2

Methyl 8-bromo-5-quinolinecarboxylate

  • Molecular FormulaC11H8BrNO2
  • Average mass266.091 Da
  • Monoisotopic mass264.973846 Da
  • ChemSpider ID24609548

More details:

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

253787-45-0 [RN]
5-Quinolinecarboxylic acid, 8-bromo-, methyl ester [ACD/Index Name]
8-Bromo-5-quinoléinecarboxylate de méthyle [French] [ACD/IUPAC Name]
Methyl 8-bromo-5-quinolinecarboxylate [ACD/IUPAC Name]
Methyl 8-bromoquinoline-5-carboxylate
Methyl-8-brom-5-chinolincarboxylat [German] [ACD/IUPAC Name]
[253787-45-0] [RN]
5-QUINOLINECARBOXYLICACID, 8-BROMO-, METHYL ESTER
5-Quinolinecarboxylicacid,8-bromo-,methyl ester
8-Bromo-quinoline-5-carboxylic acid methyl ester
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Validated by Experts, Validated by Users, Non-Validated, Removed by Users

CCRIS 4693 [DBID]

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

    Density: 1.6±0.1 g/cm3
    Boiling Point: 383.2±22.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.9 mmHg at 25°C
    Enthalpy of Vaporization: 63.2±3.0 kJ/mol
    Flash Point: 185.5±22.3 °C
    Index of Refraction: 1.641
    Molar Refractivity: 61.7±0.3 cm3
    #H bond acceptors: 3
    #H bond donors: 0
    #Freely Rotating Bonds: 2
    #Rule of 5 Violations: 0
    ACD/LogP: 2.46
    ACD/LogD (pH 5.5): 3.06
    ACD/BCF (pH 5.5): 124.78
    ACD/KOC (pH 5.5): 1101.58
    ACD/LogD (pH 7.4): 3.06
    ACD/BCF (pH 7.4): 124.78
    ACD/KOC (pH 7.4): 1101.64
    Polar Surface Area: 39 Å2
    Polarizability: 24.4±0.5 10-24cm3
    Surface Tension: 52.8±3.0 dyne/cm
    Molar Volume: 170.9±3.0 cm3

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