ChemSpider 2D Image | 4'-Methyl-5-nitro-3-biphenylcarboxylic acid | C14H11NO4

4'-Methyl-5-nitro-3-biphenylcarboxylic acid

  • Molecular FormulaC14H11NO4
  • Average mass257.241 Da
  • Monoisotopic mass257.068817 Da
  • ChemSpider ID26557128

More details:

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

[1,1'-Biphenyl]-3-carboxylic acid, 4'-methyl-5-nitro- [ACD/Index Name]
1000587-29-0 [RN]
4'-Methyl-5-nitro-[1,1'-biphenyl]-3-carboxylic acid
4'-Methyl-5-nitro-3-biphenylcarbonsäure [German] [ACD/IUPAC Name]
4'-Methyl-5-nitro-3-biphenylcarboxylic acid [ACD/IUPAC Name]
Acide 4'-méthyl-5-nitro-3-biphénylcarboxylique [French] [ACD/IUPAC Name]
[1000587-29-0] [RN]
3-(4-METHYLPHENYL)-5-NITROBENZOIC ACID
3-(4-Methylphenyl)-5-nitrobenzoicacid
4'-Methyl-5-nitro[1,1'-biphenyl]-3-carboxylic acid
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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: 1.3±0.1 g/cm3
    Boiling Point: 459.5±45.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.2 mmHg at 25°C
    Enthalpy of Vaporization: 75.9±3.0 kJ/mol
    Flash Point: 195.3±17.2 °C
    Index of Refraction: 1.626
    Molar Refractivity: 69.1±0.3 cm3
    #H bond acceptors: 5
    #H bond donors: 1
    #Freely Rotating Bonds: 3
    #Rule of 5 Violations: 0
    ACD/LogP: 4.02
    ACD/LogD (pH 5.5): 2.14
    ACD/BCF (pH 5.5): 8.03
    ACD/KOC (pH 5.5): 40.49
    ACD/LogD (pH 7.4): 1.10
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 3.67
    Polar Surface Area: 83 Å2
    Polarizability: 27.4±0.5 10-24cm3
    Surface Tension: 56.6±3.0 dyne/cm
    Molar Volume: 195.4±3.0 cm3

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