ChemSpider 2D Image | 2-(4-Isobutylphenyl)-6,8-dimethyl-4-quinolinecarboxylic acid | C22H23NO2

2-(4-Isobutylphenyl)-6,8-dimethyl-4-quinolinecarboxylic acid

  • Molecular FormulaC22H23NO2
  • Average mass333.423 Da
  • Monoisotopic mass333.172882 Da
  • ChemSpider ID21329857

More details:

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

2-(4-Isobutylphenyl)-6,8-dimethyl-4-chinolincarbonsäure [German] [ACD/IUPAC Name]
2-(4-Isobutylphenyl)-6,8-dimethyl-4-quinolinecarboxylic acid [ACD/IUPAC Name]
2-(4-Isobutylphenyl)-6,8-dimethylquinoline-4-carboxylic acid
4-Quinolinecarboxylic acid, 6,8-dimethyl-2-[4-(2-methylpropyl)phenyl]- [ACD/Index Name]
6,8-dimethyl-2-[4-(2-methylpropyl)phenyl]quinoline-4-carboxylic acid
932841-29-7 [RN]
Acide 2-(4-isobutylphényl)-6,8-diméthyl-4-quinoléinecarboxylique [French] [ACD/IUPAC Name]
VS-14164

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

MFCD03420067 [DBID]

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

    Density: 1.1±0.1 g/cm3
    Boiling Point: 509.1±50.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.4 mmHg at 25°C
    Enthalpy of Vaporization: 82.1±3.0 kJ/mol
    Flash Point: 261.7±30.1 °C
    Index of Refraction: 1.613
    Molar Refractivity: 102.1±0.3 cm3
    #H bond acceptors: 3
    #H bond donors: 1
    #Freely Rotating Bonds: 4
    #Rule of 5 Violations: 1
    ACD/LogP: 6.78
    ACD/LogD (pH 5.5): 3.71
    ACD/BCF (pH 5.5): 99.65
    ACD/KOC (pH 5.5): 185.29
    ACD/LogD (pH 7.4): 3.08
    ACD/BCF (pH 7.4): 23.20
    ACD/KOC (pH 7.4): 43.14
    Polar Surface Area: 50 Å2
    Polarizability: 40.5±0.5 10-24cm3
    Surface Tension: 47.4±3.0 dyne/cm
    Molar Volume: 293.3±3.0 cm3

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