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CAS 129027-64-1

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1-(1-Methylethyl)-1H-1,2,3-triazole-4-carboxaldehyde

Description:
1-(1-Methylethyl)-1H-1,2,3-triazole-4-carboxaldehyde, with the CAS number 129027-64-1, is a chemical compound characterized by its triazole ring structure, which is a five-membered heterocyclic compound containing three nitrogen atoms. This compound features a carboxaldehyde functional group, contributing to its reactivity and potential applications in organic synthesis. The presence of the isopropyl group (1-methylethyl) enhances its hydrophobic characteristics, influencing its solubility in various solvents. The triazole moiety is known for its biological activity, making this compound of interest in medicinal chemistry and agrochemical research. Its reactivity can be attributed to the aldehyde group, which can participate in various chemical reactions, including condensation and nucleophilic addition. Overall, this compound's unique structural features and functional groups suggest potential utility in the development of pharmaceuticals or as a building block in organic synthesis. However, specific safety and handling information should be consulted from material safety data sheets (MSDS) or relevant literature before working with this substance.
Formula:C6H9N3O
InChI:InChI=1S/C6H9N3O/c1-5(2)9-3-6(4-10)7-8-9/h3-5H,1-2H3
InChI key:InChIKey=KFEIXQJTNLBBLR-UHFFFAOYSA-N
SMILES:C(C)(C)N1C=C(C=O)N=N1
Synonyms:
  • 1H-1,2,3-Triazole-4-carboxaldehyde, 1-(1-methylethyl)-
  • 1-(Propan-2-yl)-1H-1,2,3-triazole-4-carbaldehyde
  • 1-(1-Methylethyl)-1H-1,2,3-triazole-4-carboxaldehyde
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