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CAS 153203-57-7

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1-Methyl 5-chloro-1,3-benzenedicarboxylate

Description:
1-Methyl 5-chloro-1,3-benzenedicarboxylate is an organic compound characterized by its aromatic structure, which includes a benzene ring substituted with both a methyl group and a chlorine atom, as well as two carboxylate ester groups. This compound typically exhibits a colorless to pale yellow appearance and is soluble in organic solvents. Its molecular structure suggests it may participate in various chemical reactions, including nucleophilic substitutions and esterification. The presence of the chlorine atom can influence its reactivity and polarity, while the carboxylate groups can engage in hydrogen bonding and contribute to its overall stability. This compound may be utilized in synthetic organic chemistry, particularly in the development of pharmaceuticals or agrochemicals, due to its functional groups that allow for further chemical modifications. Safety data indicates that, like many chlorinated compounds, it should be handled with care to avoid potential health hazards.
Formula:C9H7ClO4
InChI:InChI=1S/C9H7ClO4/c1-14-9(13)6-2-5(8(11)12)3-7(10)4-6/h2-4H,1H3,(H,11,12)
InChI key:InChIKey=HLARAVKGVUMKCY-UHFFFAOYSA-N
SMILES:C(OC)(=O)C1=CC(C(O)=O)=CC(Cl)=C1
Synonyms:
  • 1,3-Benzenedicarboxylic acid, 5-chloro-, 1-methyl ester
  • 1,3-Benzenedicarboxylic acid, 5-chloro-, monomethyl ester
  • 1-Methyl 5-chloro-1,3-benzenedicarboxylate
  • 5-Chloroisophthalic Acid Monomethyl Ester
  • 5-Chloroisophthalic Acid Monomethylester3-Chloro-5-(Methoxycarbonyl)Benzoic Acid
  • Chempacific 41250
  • 3-Chloro-5-(methoxycarbonyl)benzoic acid
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