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CAS 81055-73-4

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Benzoic acid, 2,6-dichloro-, ethyl ester

Description:
Benzoic acid, 2,6-dichloro-, ethyl ester, with the CAS number 81055-73-4, is an organic compound that belongs to the class of benzoic acid esters. It features a benzoic acid moiety substituted with two chlorine atoms at the 2 and 6 positions of the aromatic ring, and an ethyl ester functional group. This compound is typically a colorless to pale yellow liquid with a characteristic odor. It is moderately soluble in organic solvents and has limited solubility in water due to its hydrophobic aromatic structure. The presence of chlorine atoms enhances its reactivity and may impart specific biological activities. Benzoic acid derivatives are often used in various applications, including as preservatives, flavoring agents, and in the synthesis of other chemical compounds. Safety data should be consulted for handling, as halogenated compounds can exhibit toxicity and environmental persistence. Overall, this compound's unique structure contributes to its potential utility in both industrial and research settings.
Formula:C9H8Cl2O2
InChI:InChI=1S/C9H8Cl2O2/c1-2-13-9(12)8-6(10)4-3-5-7(8)11/h3-5H,2H2,1H3
InChI key:InChIKey=HAFAMHIZRCDTSS-UHFFFAOYSA-N
SMILES:C(OCC)(=O)C1=C(Cl)C=CC=C1Cl
Synonyms:
  • Ethyl 2,6-dichlorobenzoate
  • 2,6-Dichlorobenzoic acid ethyl ester
  • Benzoic acid, 2,6-dichloro-, ethyl ester
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