ChemSpider 2D Image | 2-(3-Methoxyphenyl)-5-pyrimidinecarbaldehyde | C12H10N2O2

2-(3-Methoxyphenyl)-5-pyrimidinecarbaldehyde

  • Molecular FormulaC12H10N2O2
  • Average mass214.220 Da
  • Monoisotopic mass214.074234 Da
  • ChemSpider ID23347298

More details:

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

1119398-70-7 [RN]
2-(3-Methoxyphenyl)-5-pyrimidincarbaldehyd [German] [ACD/IUPAC Name]
2-(3-Methoxyphenyl)-5-pyrimidinecarbaldehyde [ACD/IUPAC Name]
2-(3-Méthoxyphényl)-5-pyrimidinecarbaldéhyde [French] [ACD/IUPAC Name]
2-(3-methoxyphenyl)pyrimidine-5-carbaldehyde
2-(3-Methoxyphenyl)pyrimidine-5-carboxaldehye
5-Pyrimidinecarboxaldehyde, 2-(3-methoxyphenyl)- [ACD/Index Name]
MFCD09743684 [MDL number]
[1119398-70-7] [RN]
2-(3-methoxyphenyl)-5-Pyrimidinecarboxaldehyde
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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: 1.2±0.1 g/cm3
    Boiling Point: 293.9±32.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.6 mmHg at 25°C
    Enthalpy of Vaporization: 53.3±3.0 kJ/mol
    Flash Point: 131.5±25.1 °C
    Index of Refraction: 1.600
    Molar Refractivity: 60.5±0.3 cm3
    #H bond acceptors: 4
    #H bond donors: 0
    #Freely Rotating Bonds: 3
    #Rule of 5 Violations: 0
    ACD/LogP: 1.90
    ACD/LogD (pH 5.5): 1.87
    ACD/BCF (pH 5.5): 15.52
    ACD/KOC (pH 5.5): 247.75
    ACD/LogD (pH 7.4): 1.87
    ACD/BCF (pH 7.4): 15.52
    ACD/KOC (pH 7.4): 247.75
    Polar Surface Area: 52 Å2
    Polarizability: 24.0±0.5 10-24cm3
    Surface Tension: 50.2±3.0 dyne/cm
    Molar Volume: 176.8±3.0 cm3

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