ChemSpider 2D Image | 5-Methyl-2-(2-pyrimidinyl)benzoic acid | C12H10N2O2

5-Methyl-2-(2-pyrimidinyl)benzoic acid

  • Molecular FormulaC12H10N2O2
  • Average mass214.220 Da
  • Monoisotopic mass214.074234 Da
  • ChemSpider ID24598895

More details:

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

1088994-22-2 [RN]
5-Methyl-2-(2-pyrimidinyl)benzoic acid [ACD/IUPAC Name]
5-Methyl-2-(pyrimidin-2-yl)benzoicacid
[1088994-22-2] [RN]
5-Methyl-2-(2-pyrimidyl)benzoic Acid
5-Methyl-2-(pyrimidin-2-yl)benzoic acid
5-Methyl-2-pyrimidin-2-yl benzoic acid
5-methyl-2-pyrimidin-2-ylbenzoic acid
DS-2202
MFCD14706695 [MDL number]
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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: 315.5±42.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.7 mmHg at 25°C
    Enthalpy of Vaporization: 58.8±3.0 kJ/mol
    Flash Point: 144.6±27.9 °C
    Index of Refraction: 1.608
    Molar Refractivity: 58.8±0.3 cm3
    #H bond acceptors: 4
    #H bond donors: 1
    #Freely Rotating Bonds: 2
    #Rule of 5 Violations: 0
    ACD/LogP: 1.90
    ACD/LogD (pH 5.5): 0.49
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 6.00
    ACD/LogD (pH 7.4): -0.69
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 1.00
    Polar Surface Area: 63 Å2
    Polarizability: 23.3±0.5 10-24cm3
    Surface Tension: 57.8±3.0 dyne/cm
    Molar Volume: 170.0±3.0 cm3

    Click to predict properties on the Chemicalize site


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