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CAS 75824-03-2

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1,2,4-Triazine-6-carboxylic acid, 5-chloro-3-(methylthio)-, ethyl ester

Description:
1,2,4-Triazine-6-carboxylic acid, 5-chloro-3-(methylthio)-, ethyl ester, identified by CAS number 75824-03-2, is a chemical compound that belongs to the class of triazines, which are heterocyclic compounds containing three nitrogen atoms in a six-membered ring. This compound features a carboxylic acid functional group, which contributes to its acidity and potential reactivity. The presence of a chloro substituent and a methylthio group indicates that it may exhibit unique chemical properties, such as increased lipophilicity and potential biological activity. As an ethyl ester, it is likely to be more soluble in organic solvents compared to its acid form, which can influence its applications in various fields, including pharmaceuticals and agrochemicals. The structural characteristics suggest that it may participate in various chemical reactions, such as esterification or nucleophilic substitution. Overall, this compound's specific properties, including its stability, reactivity, and potential applications, would depend on its molecular structure and the functional groups present.
Formula:C7H8ClN3O2S
InChI:InChI=1S/C7H8ClN3O2S/c1-3-13-6(12)4-5(8)9-7(14-2)11-10-4/h3H2,1-2H3
InChI key:InChIKey=WXJHHRMJGBPYEG-UHFFFAOYSA-N
SMILES:C(OCC)(=O)C=1C(Cl)=NC(SC)=NN1
Synonyms:
  • Ethyl 5-chloro-3-methylsulfanyl-1,2,4-triazine-6-carboxylate
  • 5-Chloro-3-(methylthio)-1,2,4-triazine-6-carboxylic acid ethyl ester
  • Ethyl 5-chloro-3-(methylthio)-1,2,4-triazine-6-carboxylate
  • 1,2,4-Triazine-6-carboxylic acid, 5-chloro-3-(methylthio)-, ethyl ester
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