ChemSpider 2D Image | 2-(4-Phenoxyphenoxy)isonicotinic acid | C18H13NO4

2-(4-Phenoxyphenoxy)isonicotinic acid

  • Molecular FormulaC18H13NO4
  • Average mass307.300 Da
  • Monoisotopic mass307.084473 Da
  • ChemSpider ID23079599

More details:

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

2-(4-Phenoxyphenoxy)isonicotinic acid [ACD/IUPAC Name]
2-(4-Phenoxyphenoxy)isonicotinsäure [German] [ACD/IUPAC Name]
2-(4-phenoxyphenoxy)pyridine-4-carboxylic acid
4-Pyridinecarboxylic acid, 2-(4-phenoxyphenoxy)- [ACD/Index Name]
Acide 2-(4-phénoxyphénoxy)isonicotinique [French] [ACD/IUPAC Name]
1199215-62-7 [RN]
4-pyridinecarboxylic acid, 2-(4-phenoxyphenoxy)
MFCD13248685 [MDL number]

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

    Density: 1.3±0.1 g/cm3
    Boiling Point: 542.8±45.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.5 mmHg at 25°C
    Enthalpy of Vaporization: 86.4±3.0 kJ/mol
    Flash Point: 282.1±28.7 °C
    Index of Refraction: 1.631
    Molar Refractivity: 84.2±0.3 cm3
    #H bond acceptors: 5
    #H bond donors: 1
    #Freely Rotating Bonds: 5
    #Rule of 5 Violations: 0
    ACD/LogP: 4.30
    ACD/LogD (pH 5.5): 1.97
    ACD/BCF (pH 5.5): 5.95
    ACD/KOC (pH 5.5): 32.38
    ACD/LogD (pH 7.4): 0.94
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 3.02
    Polar Surface Area: 69 Å2
    Polarizability: 33.4±0.5 10-24cm3
    Surface Tension: 55.7±3.0 dyne/cm
    Molar Volume: 236.4±3.0 cm3

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