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CAS 1260658-95-4

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3-(Chloromethyl)-1-(2,2,2-trifluoroethyl)-1H-pyrazole

Description:
3-(Chloromethyl)-1-(2,2,2-trifluoroethyl)-1H-pyrazole is a chemical compound characterized by its unique structure, which includes a pyrazole ring substituted with both a chloromethyl group and a trifluoroethyl group. The presence of the chloromethyl group introduces a reactive site, making it useful in various synthetic applications, while the trifluoroethyl group enhances its lipophilicity and may influence its biological activity. This compound is typically a colorless to pale yellow liquid or solid, depending on its physical state at room temperature. It is important to handle this substance with care due to the presence of chlorine and fluorine, which can impart toxicity and environmental concerns. The compound's reactivity and stability can vary based on environmental conditions such as temperature and pH. Applications may include use in pharmaceuticals, agrochemicals, or as an intermediate in organic synthesis. As with any chemical, proper safety protocols should be followed when handling this substance to mitigate risks associated with its chemical properties.
Formula:C6H6ClF3N2
InChI:InChI=1S/C6H6ClF3N2/c7-3-5-1-2-12(11-5)4-6(8,9)10/h1-2H,3-4H2
InChI key:InChIKey=BKOWHECXKSAYNB-UHFFFAOYSA-N
SMILES:C(C(F)(F)F)N1N=C(CCl)C=C1
Synonyms:
  • 1H-Pyrazole, 3-(chloromethyl)-1-(2,2,2-trifluoroethyl)-
  • 3-(Chloromethyl)-1-(2,2,2-trifluoroethyl)-1H-pyrazole
  • 3-Chloromethyl-1-(2,2,2-trifluoro-ethyl)-1H-pyrazole
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