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CAS 620621-48-9

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Benzoic acid, 2-chloro-5-iodo-, methyl ester

Description:
Benzoic acid, 2-chloro-5-iodo-, methyl ester, with the CAS number 620621-48-9, is an organic compound characterized by its aromatic structure, which includes a benzoic acid moiety modified by the presence of a chlorine atom at the 2-position and an iodine atom at the 5-position of the benzene ring. The compound is an ester, specifically a methyl ester, indicating that it has a methoxy (-OCH3) group attached to the carboxylic acid functional group. This structure imparts certain chemical properties, such as increased lipophilicity compared to benzoic acid itself, which can influence its solubility and reactivity. The presence of halogen substituents (chlorine and iodine) can also affect the compound's reactivity, making it potentially useful in various chemical syntheses or as an intermediate in the production of pharmaceuticals and agrochemicals. Additionally, the compound may exhibit antimicrobial properties, which is a characteristic of many benzoic acid derivatives. Its specific applications and behavior would depend on further studies and context within chemical processes.
Formula:C8H6ClIO2
InChI:InChI=1S/C8H6ClIO2/c1-12-8(11)6-4-5(10)2-3-7(6)9/h2-4H,1H3
InChI key:InChIKey=DLSYOOCTSGXXCP-UHFFFAOYSA-N
SMILES:C(OC)(=O)C1=C(Cl)C=CC(I)=C1
Synonyms:
  • 2-Chloro-5-iodobenzoic acid methyl ester
  • Benzoic acid, 2-chloro-5-iodo-, methyl ester
  • Methyl 2-Chloro-5-Iodobenzoate
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