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Search term: 25028-33-5 (Found by approved synonym)
ChemSpider 2D Image | 2-Acetylisonicotinic acid | C8H7NO3

2-Acetylisonicotinic acid

  • Molecular FormulaC8H7NO3
  • Average mass165.146 Da
  • Monoisotopic mass165.042587 Da
  • ChemSpider ID11341465

More details:

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

25028-33-5 [RN]
2-Acetylisonicotinic acid [ACD/IUPAC Name]
2-Acetylisonicotinsäure [German] [ACD/IUPAC Name]
4-Pyridinecarboxylic acid, 2-acetyl- [ACD/Index Name]
Acide 2-acétylisonicotinique
Acide 2-acétylisonicotinique [French] [ACD/IUPAC Name]
2-Acetyl-4-pyridinecarboxylic acid
2-acetyl-isonicotinic acid
2-acetylpyridine-4-carboxylic acid
MFCD11036201

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: 444.4±30.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.1 mmHg at 25°C
    Enthalpy of Vaporization: 74.0±3.0 kJ/mol
    Flash Point: 222.6±24.6 °C
    Index of Refraction: 1.565
    Molar Refractivity: 41.3±0.3 cm3
    #H bond acceptors: 4
    #H bond donors: 1
    #Freely Rotating Bonds: 2
    #Rule of 5 Violations: 0
    ACD/LogP: 0.90
    ACD/LogD (pH 5.5): -1.78
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 1.00
    ACD/LogD (pH 7.4): -2.39
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 1.00
    Polar Surface Area: 67 Å2
    Polarizability: 16.4±0.5 10-24cm3
    Surface Tension: 57.4±3.0 dyne/cm
    Molar Volume: 126.7±3.0 cm3

    Click to predict properties on the Chemicalize site


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