ChemSpider 2D Image | 5-Bromo-2-quinolinecarboxylic acid | C10H6BrNO2

5-Bromo-2-quinolinecarboxylic acid

  • Molecular FormulaC10H6BrNO2
  • Average mass252.064 Da
  • Monoisotopic mass250.958176 Da
  • ChemSpider ID21783936

More details:

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

1017412-53-1 [RN]
2-Quinolinecarboxylic acid, 5-bromo- [ACD/Index Name]
5-Brom-2-chinolincarbonsäure [German] [ACD/IUPAC Name]
5-Bromo-2-quinolinecarboxylic acid [ACD/IUPAC Name]
5-bromoquinoline-2-carboxylic acid
Acide 5-bromo-2-quinoléinecarboxylique [French] [ACD/IUPAC Name]
[1017412-53-1] [RN]
155849-49-3 [RN]
4'-Hydroxy-4-biphenylcarbonitrile
4'-Hydroxy-4-biphenylcarbonitrile [ACD/IUPAC Name]
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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: 1.7±0.1 g/cm3
    Boiling Point: 403.1±30.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.0 mmHg at 25°C
    Enthalpy of Vaporization: 69.0±3.0 kJ/mol
    Flash Point: 197.6±24.6 °C
    Index of Refraction: 1.709
    Molar Refractivity: 56.8±0.3 cm3
    #H bond acceptors: 3
    #H bond donors: 1
    #Freely Rotating Bonds: 1
    #Rule of 5 Violations: 0
    ACD/LogP: 3.15
    ACD/LogD (pH 5.5): 1.38
    ACD/BCF (pH 5.5): 2.54
    ACD/KOC (pH 5.5): 21.97
    ACD/LogD (pH 7.4): 0.08
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 1.10
    Polar Surface Area: 50 Å2
    Polarizability: 22.5±0.5 10-24cm3
    Surface Tension: 68.1±3.0 dyne/cm
    Molar Volume: 145.5±3.0 cm3

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