ChemSpider 2D Image | 5-Chloro-4'-(methoxycarbonyl)-3-biphenylcarboxylic acid | C15H11ClO4

5-Chloro-4'-(methoxycarbonyl)-3-biphenylcarboxylic acid

  • Molecular FormulaC15H11ClO4
  • Average mass290.698 Da
  • Monoisotopic mass290.034576 Da
  • ChemSpider ID26541126

More details:

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

1262004-81-8 [RN]
[1,1'-Biphenyl]-3,4'-dicarboxylic acid, 5-chloro-, 4'-methyl ester [ACD/Index Name]
5-Chlor-4'-(methoxycarbonyl)-3-biphenylcarbonsäure [German] [ACD/IUPAC Name]
5-Chloro-3-(4-methoxycarbonylphenyl)benzoic acid
5-Chloro-4'-(methoxycarbonyl)[1,1'-biphenyl]-3-carboxylic acid
5-Chloro-4'-(methoxycarbonyl)-3-biphenylcarboxylic acid [ACD/IUPAC Name]
Acide 5-chloro-4'-(méthoxycarbonyl)-3-biphénylcarboxylique [French] [ACD/IUPAC Name]
MFCD18321242
YB-1486

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

    Density: 1.3±0.1 g/cm3
    Boiling Point: 477.4±40.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.3 mmHg at 25°C
    Enthalpy of Vaporization: 78.1±3.0 kJ/mol
    Flash Point: 242.5±27.3 °C
    Index of Refraction: 1.602
    Molar Refractivity: 74.4±0.3 cm3
    #H bond acceptors: 4
    #H bond donors: 1
    #Freely Rotating Bonds: 4
    #Rule of 5 Violations: 0
    ACD/LogP: 4.68
    ACD/LogD (pH 5.5): 2.85
    ACD/BCF (pH 5.5): 31.67
    ACD/KOC (pH 5.5): 124.88
    ACD/LogD (pH 7.4): 1.63
    ACD/BCF (pH 7.4): 1.89
    ACD/KOC (pH 7.4): 7.46
    Polar Surface Area: 64 Å2
    Polarizability: 29.5±0.5 10-24cm3
    Surface Tension: 52.2±3.0 dyne/cm
    Molar Volume: 217.1±3.0 cm3

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