ChemSpider 2D Image | 2-Bromo-4H-pyrrolo[2,3-b]pyrazine | C6H4BrN3

2-Bromo-4H-pyrrolo[2,3-b]pyrazine

  • Molecular FormulaC6H4BrN3
  • Average mass198.020 Da
  • Monoisotopic mass196.958847 Da
  • ChemSpider ID21109237

More details:

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

2-Brom-5H-pyrrolo[2,3-b]pyrazin [German] [ACD/IUPAC Name]
2-Bromo-4H-pyrrolo[2,3-b]pyrazine
2-bromo-5H-pyrrolo[2,3-b]pyrazine [ACD/IUPAC Name]
2-Bromo-5H-pyrrolo[2,3-b]pyrazine [French] [ACD/IUPAC Name]
5H-Pyrrolo[2,3-b]pyrazine, 2-bromo- [ACD/Index Name]
875781-43-4 [RN]
[875781-43-4] [RN]
126066-54-4 [RN]
2-​bromo-​5h-​pyrrolo[2,​3-​b]​pyrazine
27305-70-0 [RN]
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Validated by Experts, Validated by Users, Non-Validated, Removed by Users

87781-43-45 [DBID]
CCRIS 4693 [DBID]

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

    Density: 1.9±0.1 g/cm3
    Boiling Point: 314.5±37.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.6 mmHg at 25°C
    Enthalpy of Vaporization: 53.4±3.0 kJ/mol
    Flash Point: 144.0±26.5 °C
    Index of Refraction: 1.746
    Molar Refractivity: 42.4±0.3 cm3
    #H bond acceptors: 3
    #H bond donors: 1
    #Freely Rotating Bonds: 0
    #Rule of 5 Violations: 0
    ACD/LogP: 2.13
    ACD/LogD (pH 5.5): 1.39
    ACD/BCF (pH 5.5): 6.75
    ACD/KOC (pH 5.5): 136.58
    ACD/LogD (pH 7.4): 1.39
    ACD/BCF (pH 7.4): 6.75
    ACD/KOC (pH 7.4): 136.50
    Polar Surface Area: 42 Å2
    Polarizability: 16.8±0.5 10-24cm3
    Surface Tension: 76.9±3.0 dyne/cm
    Molar Volume: 104.5±3.0 cm3

    Click to predict properties on the Chemicalize site


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