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CAS 1260672-42-1

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2-(Chloromethyl)-5-(trifluoromethyl)-1,3,4-thiadiazole

Description:
2-(Chloromethyl)-5-(trifluoromethyl)-1,3,4-thiadiazole is a heterocyclic compound characterized by the presence of a thiadiazole ring, which consists of two nitrogen atoms and one sulfur atom in a five-membered ring structure. The compound features a chloromethyl group (-CH2Cl) and a trifluoromethyl group (-CF3) attached to the thiadiazole ring, which significantly influences its chemical reactivity and physical properties. The chloromethyl group can participate in nucleophilic substitution reactions, while the trifluoromethyl group enhances the compound's lipophilicity and stability. This compound is typically a solid at room temperature and may exhibit moderate solubility in organic solvents. Its unique structure makes it of interest in various fields, including pharmaceuticals and agrochemicals, where it may serve as a building block for the synthesis of more complex molecules. Additionally, the presence of fluorine atoms often imparts desirable properties such as increased metabolic stability and altered biological activity.
Formula:C4H2ClF3N2S
InChI:InChI=1S/C4H2ClF3N2S/c5-1-2-9-10-3(11-2)4(6,7)8/h1H2
InChI key:InChIKey=ITNASIFWWJRCED-UHFFFAOYSA-N
SMILES:C(F)(F)(F)C=1SC(CCl)=NN1
Synonyms:
  • 1,3,4-Thiadiazole, 2-(chloromethyl)-5-(trifluoromethyl)-
  • 2-(Chloromethyl)-5-(trifluoromethyl)-1,3,4-thiadiazole
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