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CAS 23195-59-7

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5-(4-chlorophenyl)-1H-1,2,4-triazole

Description:
5-(4-Chlorophenyl)-1H-1,2,4-triazole is a chemical compound characterized by its triazole ring, which is a five-membered heterocyclic structure containing three nitrogen atoms. This compound features a 4-chlorophenyl group, indicating the presence of a chlorinated phenyl substituent that can influence its chemical reactivity and biological activity. It is typically a solid at room temperature and may exhibit moderate solubility in organic solvents. The presence of the triazole moiety often imparts unique properties, making it of interest in various fields, including pharmaceuticals and agrochemicals, due to its potential as a fungicide or herbicide. The chlorophenyl group can enhance the lipophilicity of the compound, affecting its interaction with biological targets. Additionally, the compound may exhibit specific spectral characteristics in techniques such as NMR and IR spectroscopy, which can be used for its identification and characterization. Safety data should be consulted for handling and usage, as with any chemical substance.
Formula:C8H6ClN3
InChI:InChI=1/C8H6ClN3/c9-7-3-1-6(2-4-7)8-10-5-11-12-8/h1-5H,(H,10,11,12)
SMILES:c1cc(ccc1c1nc[nH]n1)Cl
Synonyms:
  • 1H-1,2,4-triazole, 3-(4-chlorophenyl)-
  • 3-(4-Chlorophenyl)-1H-1,2,4-triazole
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