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CAS 16227-12-6

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4-Phenyl-4H-1,2,4-triazole

Description:
4-Phenyl-4H-1,2,4-triazole is an organic compound characterized by its triazole ring structure, which consists of three nitrogen atoms and two carbon atoms in a five-membered ring. The presence of a phenyl group at the 4-position of the triazole ring contributes to its aromatic properties and influences its chemical reactivity and solubility. This compound is typically a white to off-white solid and is known for its potential applications in various fields, including pharmaceuticals and agrochemicals, due to its biological activity. It may exhibit antifungal, antibacterial, or herbicidal properties, making it of interest in medicinal chemistry and crop protection. The compound's stability, solubility in organic solvents, and reactivity with other chemical species can vary based on environmental conditions. As with many nitrogen-containing heterocycles, it may participate in various chemical reactions, including nucleophilic substitutions and coordination with metal ions. Safety data should be consulted for handling and usage, as with any chemical substance.
Formula:C8H7N3
InChI:InChI=1S/C8H7N3/c1-2-4-8(5-3-1)11-6-9-10-7-11/h1-7H
InChI key:InChIKey=YAHHNSBXSDGEFB-UHFFFAOYSA-N
SMILES:N1(C=NN=C1)C2=CC=CC=C2
Synonyms:
  • 1-Phenyl-1,3,4-triazole
  • 4-Phenyl-1,2,4-triazole
  • 4H-1,2,4-triazole, 4-phenyl-
  • 4-Phenyl-4H-1,2,4-triazole
  • 4-Phenyl-4H-1,2,4-triazole
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Purity (%)
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90
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95
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100
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