ChemSpider 2D Image | Methyl 5-bromo-2-pyrazinecarboxylate | C6H5BrN2O2

Methyl 5-bromo-2-pyrazinecarboxylate

  • Molecular FormulaC6H5BrN2O2
  • Average mass217.020 Da
  • Monoisotopic mass215.953430 Da
  • ChemSpider ID23347155

More details:

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

210037-58-4 [RN]
2-Pyrazinecarboxylic acid, 5-bromo-, methyl ester [ACD/Index Name]
5-Bromo-2-pyrazinecarboxylate de méthyle [French] [ACD/IUPAC Name]
5-Bromopyrazine-2-carboxylic acid methyl ester
Methyl 2-bromo-5-pyrazinecarboxylate
Methyl 5-bromo-2-pyrazinecarboxylate [ACD/IUPAC Name]
Methyl-5-brom-2-pyrazincarboxylat [German] [ACD/IUPAC Name]
T6N DNJ BVO1 EE [WLN]
5-Bromo-2-(methoxycarbonyl)-1,4-diazine
5-Bromo-2-(methoxycarbonyl)pyrazine
More...

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

AGN-PC-059B9Y [DBID]
AMPZ0012 [DBID]
BR-24801 [DBID]
CCRIS 4693 [DBID]
CTK4E5640 [DBID]
KSC545M4B [DBID]
MolPort-009-198-468 [DBID]
SCHEMBL2134366 [DBID]
ST-9948 [DBID]

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

    Density: 1.7±0.1 g/cm3
    Boiling Point: 289.0±35.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.6 mmHg at 25°C
    Enthalpy of Vaporization: 52.8±3.0 kJ/mol
    Flash Point: 128.6±25.9 °C
    Index of Refraction: 1.558
    Molar Refractivity: 41.9±0.3 cm3
    #H bond acceptors: 4
    #H bond donors: 0
    #Freely Rotating Bonds: 2
    #Rule of 5 Violations: 0
    ACD/LogP: 0.71
    ACD/LogD (pH 5.5): 0.72
    ACD/BCF (pH 5.5): 2.07
    ACD/KOC (pH 5.5): 58.52
    ACD/LogD (pH 7.4): 0.72
    ACD/BCF (pH 7.4): 2.07
    ACD/KOC (pH 7.4): 58.52
    Polar Surface Area: 52 Å2
    Polarizability: 16.6±0.5 10-24cm3
    Surface Tension: 53.2±3.0 dyne/cm
    Molar Volume: 130.0±3.0 cm3

    Click to predict properties on the Chemicalize site


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