ChemSpider 2D Image | 2-Bromo-5-(4-methoxybenzyl)-5H-pyrrolo[2,3-b]pyrazine | C14H12BrN3O

2-Bromo-5-(4-methoxybenzyl)-5H-pyrrolo[2,3-b]pyrazine

  • Molecular FormulaC14H12BrN3O
  • Average mass318.169 Da
  • Monoisotopic mass317.016357 Da
  • ChemSpider ID34979886

More details:

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

1434141-87-3 [RN]
2-Brom-5-(4-methoxybenzyl)-5H-pyrrolo[2,3-b]pyrazin [German] [ACD/IUPAC Name]
2-Bromo-5-(4-methoxybenzyl)-5H-pyrrolo[2,3-b]pyrazine [ACD/IUPAC Name]
2-Bromo-5-(4-méthoxybenzyl)-5H-pyrrolo[2,3-b]pyrazine [French] [ACD/IUPAC Name]
5H-Pyrrolo[2,3-b]pyrazine, 2-bromo-5-[(4-methoxyphenyl)methyl]- [ACD/Index Name]
2-bromo-5-[(4-methoxyphenyl)methyl]-5H-pyrrolo[2,3-b]pyrazine
Chemistry 14596
MFCD27956947

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

    Density: 1.5±0.1 g/cm3
    Boiling Point: 456.1±45.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.1 mmHg at 25°C
    Enthalpy of Vaporization: 68.8±3.0 kJ/mol
    Flash Point: 229.6±28.7 °C
    Index of Refraction: 1.664
    Molar Refractivity: 78.2±0.5 cm3
    #H bond acceptors: 4
    #H bond donors: 0
    #Freely Rotating Bonds: 3
    #Rule of 5 Violations: 0
    ACD/LogP: 4.15
    ACD/LogD (pH 5.5): 4.10
    ACD/BCF (pH 5.5): 772.82
    ACD/KOC (pH 5.5): 4063.33
    ACD/LogD (pH 7.4): 4.10
    ACD/BCF (pH 7.4): 772.84
    ACD/KOC (pH 7.4): 4063.45
    Polar Surface Area: 40 Å2
    Polarizability: 31.0±0.5 10-24cm3
    Surface Tension: 49.5±7.0 dyne/cm
    Molar Volume: 210.9±7.0 cm3

    Click to predict properties on the Chemicalize site


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