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CAS 109803-48-7

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Benzoic acid, 5-chloro-4-methoxy-2-methyl-, methyl ester

Description:
Benzoic acid, 5-chloro-4-methoxy-2-methyl-, methyl ester, identified by the CAS number 109803-48-7, is an organic compound characterized by its ester functional group, which is derived from benzoic acid. This compound features a benzene ring substituted with a chlorine atom, a methoxy group, and a methyl group, contributing to its unique chemical properties. The presence of these substituents influences its reactivity, solubility, and potential applications. Typically, compounds of this nature exhibit moderate polarity due to the ester and methoxy groups, which can enhance their solubility in organic solvents. Additionally, the chlorine substituent may impart specific biological activities, making such compounds of interest in pharmaceutical and agrochemical research. The compound's structure suggests potential uses in synthesis and as an intermediate in the production of other chemical entities. As with many organic compounds, safety and handling precautions should be observed, given the potential for toxicity associated with halogenated compounds.
Formula:C10H11ClO3
InChI:InChI=1S/C10H11ClO3/c1-6-4-9(13-2)8(11)5-7(6)10(12)14-3/h4-5H,1-3H3
InChI key:InChIKey=YPPCIMDEHVUNPU-UHFFFAOYSA-N
SMILES:C(OC)(=O)C1=C(C)C=C(OC)C(Cl)=C1
Synonyms:
  • Benzoic acid, 5-chloro-4-methoxy-2-methyl-, methyl ester
  • Methyl 5-chloro-4-methoxy-2-methylbenzoate
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