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CAS 235106-13-5

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4-Chloro-3-phenyl-5-(trifluoromethyl)-1H-pyrazole

Description:
4-Chloro-3-phenyl-5-(trifluoromethyl)-1H-pyrazole is a chemical compound characterized by its pyrazole core, which is a five-membered ring containing two nitrogen atoms. The presence of a chloro group at the 4-position and a trifluoromethyl group at the 5-position contributes to its unique reactivity and properties. The phenyl group at the 3-position enhances its aromatic character and may influence its interactions in biological systems. This compound is typically a solid at room temperature and is known for its potential applications in pharmaceuticals and agrochemicals, often exhibiting biological activity due to its structural features. The trifluoromethyl group is particularly notable for imparting lipophilicity and metabolic stability, making such compounds of interest in drug design. Additionally, the presence of halogens can affect the compound's solubility and reactivity, which are critical factors in its application in various chemical processes. Safety data should be consulted for handling and storage, as halogenated compounds can pose environmental and health risks.
Formula:C10H6ClF3N2
InChI:InChI=1S/C10H6ClF3N2/c11-7-8(6-4-2-1-3-5-6)15-16-9(7)10(12,13)14/h1-5H,(H,15,16)
InChI key:InChIKey=RJIXEBOSMSSXJC-UHFFFAOYSA-N
SMILES:ClC=1C(=NNC1C(F)(F)F)C2=CC=CC=C2
Synonyms:
  • 1H-Pyrazole, 4-chloro-3-phenyl-5-(trifluoromethyl)-
  • 4-Chloro-5-phenyl-3-trifluoromethyl-2H-pyrazole
  • 4-Chloro-3-phenyl-5-(trifluoromethyl)-1H-pyrazole
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