ChemSpider 2D Image | MFCD11933379 | C12H9NO3

MFCD11933379

  • Molecular FormulaC12H9NO3
  • Average mass215.205 Da
  • Monoisotopic mass215.058243 Da
  • ChemSpider ID25466218

More details:

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

1181452-05-0 [RN]
3-Pyridinecarboxylic acid, 5-(3-hydroxyphenyl)- [ACD/Index Name]
5-(3-Hydroxyphenyl)nicotinic acid [ACD/IUPAC Name]
5-(3-Hydroxyphenyl)nicotinsäure [German] [ACD/IUPAC Name]
5-(3-hydroxyphenyl)pyridine-3-carboxylic acid
Acide 5-(3-hydroxyphényl)nicotinique [French] [ACD/IUPAC Name]
MFCD11933379
[1181452-05-0] [RN]
5-(3-Hydroxyphenyl)-nicotinic acid
5-(3-Hydroxyphenyl)nicotinicacid
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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: 1.4±0.1 g/cm3
    Boiling Point: 504.2±45.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.4 mmHg at 25°C
    Enthalpy of Vaporization: 81.5±3.0 kJ/mol
    Flash Point: 258.7±28.7 °C
    Index of Refraction: 1.647
    Molar Refractivity: 57.7±0.3 cm3
    #H bond acceptors: 4
    #H bond donors: 2
    #Freely Rotating Bonds: 2
    #Rule of 5 Violations: 0
    ACD/LogP: 1.52
    ACD/LogD (pH 5.5): 0.02
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 2.81
    ACD/LogD (pH 7.4): -1.00
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 1.00
    Polar Surface Area: 70 Å2
    Polarizability: 22.9±0.5 10-24cm3
    Surface Tension: 65.4±3.0 dyne/cm
    Molar Volume: 158.9±3.0 cm3

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