ChemSpider 2D Image | 2-(4-sec-Butylphenyl)-8-methyl-4-quinolinecarboxylic acid | C21H21NO2

2-(4-sec-Butylphenyl)-8-methyl-4-quinolinecarboxylic acid

  • Molecular FormulaC21H21NO2
  • Average mass319.397 Da
  • Monoisotopic mass319.157227 Da
  • ChemSpider ID21329849

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

2-(4-(sec-Butyl)phenyl)-8-methylquinoline-4-carboxylic acid
2-(4-sec-Butylphenyl)-8-methyl-4-chinolincarbonsäure [German] [ACD/IUPAC Name]
2-(4-sec-Butylphenyl)-8-methyl-4-quinolinecarboxylic acid [ACD/IUPAC Name]
2-(4-sec-Butylphenyl)-8-methylquinoline-4-carboxylic acid
2-[4-(butan-2-yl)phenyl]-8-methylquinoline-4-carboxylic acid
4-Quinolinecarboxylic acid, 8-methyl-2-[4-(1-methylpropyl)phenyl]- [ACD/Index Name]
8-METHYL-2-[4-(SEC-BUTYL)PHENYL]QUINOLINE-4-CARBOXYLIC ACID
932796-03-7 [RN]
Acide 2-(4-sec-butylphényl)-8-méthyl-4-quinoléinecarboxylique [French] [ACD/IUPAC Name]
2-(4-butan-2-ylphenyl)-8-methylquinoline-4-carboxylic acid
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Validated by Experts, Validated by Users, Non-Validated, Removed by Users

MFCD03420031 [DBID]

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

    Density: 1.2±0.1 g/cm3
    Boiling Point: 492.1±45.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.3 mmHg at 25°C
    Enthalpy of Vaporization: 79.9±3.0 kJ/mol
    Flash Point: 251.4±28.7 °C
    Index of Refraction: 1.619
    Molar Refractivity: 97.4±0.3 cm3
    #H bond acceptors: 3
    #H bond donors: 1
    #Freely Rotating Bonds: 4
    #Rule of 5 Violations: 1
    ACD/LogP: 6.32
    ACD/LogD (pH 5.5): 3.32
    ACD/BCF (pH 5.5): 48.82
    ACD/KOC (pH 5.5): 108.76
    ACD/LogD (pH 7.4): 2.71
    ACD/BCF (pH 7.4): 12.08
    ACD/KOC (pH 7.4): 26.92
    Polar Surface Area: 50 Å2
    Polarizability: 38.6±0.5 10-24cm3
    Surface Tension: 48.8±3.0 dyne/cm
    Molar Volume: 277.4±3.0 cm3

    Click to predict properties on the Chemicalize site


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