ChemSpider 2D Image | 5-(4-Methoxyphenyl)-2,3-pyrazinedicarboxylic acid | C13H10N2O5

5-(4-Methoxyphenyl)-2,3-pyrazinedicarboxylic acid

  • Molecular FormulaC13H10N2O5
  • Average mass274.229 Da
  • Monoisotopic mass274.058960 Da
  • ChemSpider ID21470353

More details:






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

2,3-Pyrazinedicarboxylic acid, 5-(4-methoxyphenyl)- [ACD/Index Name]
5-(4-Methoxyphenyl)-2,3-pyrazindicarbonsäure [German] [ACD/IUPAC Name]
5-(4-Methoxyphenyl)-2,3-pyrazinedicarboxylic acid [ACD/IUPAC Name]
5-(4-methoxyphenyl)pyrazine-2,3-dicarboxylic acid
80356-80-5 [RN]
Acide 5-(4-méthoxyphényl)-2,3-pyrazinedicarboxylique [French] [ACD/IUPAC Name]
5-(4-Methoxy-phenyl)-pyrazine-2,3-dicarboxylic acid
atoms 20 bonds 21
MFCD11226424

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

    Density: 1.4±0.1 g/cm3
    Boiling Point: 527.6±50.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.5 mmHg at 25°C
    Enthalpy of Vaporization: 84.4±3.0 kJ/mol
    Flash Point: 272.9±30.1 °C
    Index of Refraction: 1.629
    Molar Refractivity: 67.6±0.3 cm3
    #H bond acceptors: 7
    #H bond donors: 2
    #Freely Rotating Bonds: 4
    #Rule of 5 Violations: 0
    ACD/LogP: -1.02
    ACD/LogD (pH 5.5): -2.68
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 1.00
    ACD/LogD (pH 7.4): -2.96
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 1.00
    Polar Surface Area: 110 Å2
    Polarizability: 26.8±0.5 10-24cm3
    Surface Tension: 69.8±3.0 dyne/cm
    Molar Volume: 190.2±3.0 cm3

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