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CAS 512809-96-0

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Ethyl 4-chloro-1,5-dimethyl-1H-pyrazole-3-carboxylate

Description:
Ethyl 4-chloro-1,5-dimethyl-1H-pyrazole-3-carboxylate is a chemical compound characterized by its pyrazole ring structure, which is a five-membered heterocyclic compound containing two nitrogen atoms. This substance features a chloro substituent at the 4-position and two methyl groups at the 1 and 5 positions of the pyrazole ring, contributing to its unique reactivity and properties. The ethyl ester functional group at the 3-position enhances its solubility in organic solvents and may influence its biological activity. Typically, compounds of this nature are of interest in medicinal chemistry and agricultural applications, often exhibiting herbicidal or fungicidal properties. The presence of the chloro group can also affect the compound's electronic properties and reactivity, making it a potential candidate for further chemical modifications. Safety data sheets should be consulted for handling and storage guidelines, as with any chemical substance, to ensure proper safety measures are taken.
Formula:C8H11ClN2O2
InChI:InChI=1S/C8H11ClN2O2/c1-4-13-8(12)7-6(9)5(2)11(3)10-7/h4H2,1-3H3
InChI key:InChIKey=LWNZAEYHLNHDGN-UHFFFAOYSA-N
SMILES:C(OCC)(=O)C=1C(Cl)=C(C)N(C)N1
Synonyms:
  • Ethyl 4-chloro-1,5-dimethyl-1H-pyrazole-3-carboxylate
  • 1H-Pyrazole-3-carboxylic acid, 4-chloro-1,5-dimethyl-, ethyl ester
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