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CAS 36070-83-4

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2-Pyrazinecarboxylic acid, 5-bromo-, ethyl ester

Description:
2-Pyrazinecarboxylic acid, 5-bromo-, ethyl ester, with the CAS number 36070-83-4, is an organic compound characterized by its pyrazine ring structure, which is a six-membered aromatic heterocycle containing two nitrogen atoms. This compound features a carboxylic acid functional group and an ethyl ester moiety, contributing to its reactivity and solubility properties. The presence of the bromine atom at the 5-position of the pyrazine ring enhances its electrophilic character, making it useful in various chemical reactions, including substitution and coupling reactions. Typically, this compound is a solid at room temperature and may exhibit moderate solubility in polar organic solvents. Its derivatives are often explored in medicinal chemistry and agrochemicals due to their potential biological activities. The compound's synthesis usually involves the bromination of 2-pyrazinecarboxylic acid followed by esterification with ethanol. Safety data should be consulted for handling, as with many organic compounds, it may pose health risks if not managed properly.
Formula:C7H7BrN2O2
InChI:InChI=1S/C7H7BrN2O2/c1-2-12-7(11)5-3-10-6(8)4-9-5/h3-4H,2H2,1H3
InChI key:InChIKey=YMWDNHSAHXMMHH-UHFFFAOYSA-N
SMILES:C(OCC)(=O)C=1C=NC(Br)=CN1
Synonyms:
  • 2-Pyrazinecarboxylic Acid, 5-Bromo-, Ethyl Ester
  • Ethyl 5-Bromo-2-Pyrazinecarboxylate
  • Pyrazinecarboxylic acid, 5-bromo-, ethyl ester
  • Ethyl 5-bromopyrazine-2-carboxylate
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