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CAS 40689-36-9

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Ethyl 3,5-dichloro-4-(1-methylethoxy)benzoate

Description:
Ethyl 3,5-dichloro-4-(1-methylethoxy)benzoate, with the CAS number 40689-36-9, is an organic compound that belongs to the class of benzoates. It features a benzoic acid derivative structure, characterized by the presence of two chlorine atoms at the 3 and 5 positions of the aromatic ring, which contribute to its reactivity and potential biological activity. The ethyl ester group enhances its solubility in organic solvents, making it useful in various applications, including as an intermediate in organic synthesis. The 1-methylethoxy substituent adds steric bulk, which can influence the compound's interactions with biological targets. This compound may exhibit properties such as antimicrobial or herbicidal activity, typical of many chlorinated aromatic compounds. Safety data should be consulted for handling and exposure risks, as halogenated compounds can pose environmental and health hazards. Overall, Ethyl 3,5-dichloro-4-(1-methylethoxy)benzoate is a structurally interesting compound with potential applications in chemical synthesis and agrochemicals.
Formula:C12H14Cl2O3
InChI:InChI=1S/C12H14Cl2O3/c1-4-16-12(15)8-5-9(13)11(10(14)6-8)17-7(2)3/h5-7H,4H2,1-3H3
InChI key:InChIKey=OSXWGQCZIUQALB-UHFFFAOYSA-N
SMILES:O(C(C)C)C1=C(Cl)C=C(C(OCC)=O)C=C1Cl
Synonyms:
  • Ethyl 3,5-dichloro-4-(1-methylethoxy)benzoate
  • Ethyl 3,5-dichloro-4-isopropoxybenzoate
  • Benzoic acid, 3,5-dichloro-4-(1-methylethoxy)-, ethyl ester
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