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CAS 886361-50-8

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Methyl 4-[5-(chloromethyl)-2-pyridinyl]benzoate

Description:
Methyl 4-[5-(chloromethyl)-2-pyridinyl]benzoate, with the CAS number 886361-50-8, is an organic compound characterized by its complex structure that includes a benzoate moiety and a pyridine ring. This compound features a chloromethyl group attached to the pyridine, which can influence its reactivity and potential applications in synthesis. Typically, such compounds exhibit moderate to high polarity due to the presence of both aromatic and heteroaromatic systems, which can affect their solubility in various solvents. The chloromethyl group may serve as a reactive site for further chemical modifications, making it useful in medicinal chemistry and material science. Additionally, the presence of the methyl ester group suggests that it may undergo hydrolysis under certain conditions, releasing methanol and forming the corresponding carboxylic acid. Overall, this compound's unique structural features may contribute to its utility in various chemical reactions and applications, particularly in the development of pharmaceuticals or agrochemicals.
Formula:C14H12ClNO2
InChI:InChI=1S/C14H12ClNO2/c1-18-14(17)12-5-3-11(4-6-12)13-7-2-10(8-15)9-16-13/h2-7,9H,8H2,1H3
InChI key:InChIKey=ZLQQSIUJKPYNEW-UHFFFAOYSA-N
SMILES:C(OC)(=O)C1=CC=C(C=C1)C2=CC=C(CCl)C=N2
Synonyms:
  • Benzoic acid, 4-[5-(chloromethyl)-2-pyridinyl]-, methyl ester
  • Methyl 4-[5-(chloromethyl)-2-pyridinyl]benzoate
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