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CAS 157652-33-0

:

Benzoic acid, 3-bromo-4-chloro-2-methyl-, ethyl ester

Description:
Benzoic acid, 3-bromo-4-chloro-2-methyl-, ethyl ester, with the CAS number 157652-33-0, is an organic compound that belongs to the class of benzoic acid derivatives. This substance features a benzoic acid core substituted with a bromine atom at the 3-position, a chlorine atom at the 4-position, and a methyl group at the 2-position, along with an ethyl ester functional group. The presence of halogen substituents (bromine and chlorine) can influence its reactivity and polarity, potentially enhancing its biological activity. The ethyl ester moiety contributes to its solubility in organic solvents and may affect its volatility and boiling point. This compound may be of interest in various fields, including pharmaceuticals and agrochemicals, due to its potential applications as an intermediate in synthesis or as a bioactive agent. As with many organic compounds, safety data should be consulted to understand its handling, storage, and potential hazards.
Formula:C10H10BrClO2
InChI:InChI=1S/C10H10BrClO2/c1-3-14-10(13)7-4-5-8(12)9(11)6(7)2/h4-5H,3H2,1-2H3
InChI key:InChIKey=WKOFEYJLYIZHEI-UHFFFAOYSA-N
SMILES:C(OCC)(=O)C1=C(C)C(Br)=C(Cl)C=C1
Synonyms:
  • Ethyl 3-bromo-4-chloro-2-methylbenzoate
  • Benzoic acid, 3-bromo-4-chloro-2-methyl-, ethyl ester
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