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CAS 647020-70-0

:

benzoic acid, 2-chloro-3-fluoro-, methyl ester

Description:
Benzoic acid, 2-chloro-3-fluoro-, methyl ester, with the CAS number 647020-70-0, is an organic compound characterized by its ester functional group, which is formed from benzoic acid and methanol. This compound features a benzene ring substituted with both a chlorine atom at the 2-position and a fluorine atom at the 3-position, contributing to its unique chemical properties. The presence of these halogen substituents can influence the compound's reactivity, polarity, and solubility. Typically, esters like this one are known for their pleasant aromas and are often used in flavoring and fragrance applications. Additionally, the presence of halogens may enhance the compound's stability and alter its biological activity, making it of interest in pharmaceutical and agrochemical research. The molecular structure suggests potential applications in various chemical syntheses and as intermediates in the production of more complex molecules. As with many organic compounds, safety and handling precautions should be observed due to potential toxicity and environmental impact.
Formula:C8H6ClFO2
InChI:InChI=1/C8H6ClFO2/c1-12-8(11)5-3-2-4-6(10)7(5)9/h2-4H,1H3
SMILES:COC(=O)c1cccc(c1Cl)F
Synonyms:
  • Methyl 2-chloro-3-fluorobenzoate
  • Benzoic acid, 2-chloro-3-fluoro-, methyl ester
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