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CAS 887407-15-0

:

1,1-Dimethylethyl N-(imino-1H-1,2,4-triazol-1-ylmethyl)carbamate

Description:
1,1-Dimethylethyl N-(imino-1H-1,2,4-triazol-1-ylmethyl)carbamate, identified by its CAS number 887407-15-0, is a chemical compound that features a carbamate functional group linked to a triazole moiety. This compound is characterized by its potential use in agricultural applications, particularly as a pesticide or herbicide, due to the presence of the triazole ring, which is known for its biological activity. The structure includes a tert-butyl group, contributing to its lipophilicity and stability. The imino group in the triazole enhances its reactivity and interaction with biological targets. Additionally, the compound may exhibit specific solubility characteristics, influencing its application in formulations. Its synthesis typically involves the reaction of appropriate precursors under controlled conditions to ensure the desired functional groups are preserved. As with many chemical substances, safety data and handling precautions are essential, given the potential for toxicity or environmental impact. Overall, this compound represents a class of chemicals with significant relevance in agrochemistry and possibly other fields of research.
Formula:C8H13N5O2
InChI:InChI=1/C8H13N5O2/c1-8(2,3)15-7(14)12-6(9)13-5-10-4-11-13/h4-5H,1-3H3,(H2,9,12,14)
InChI key:InChIKey=SKSIGJGFRUKGOA-UHFFFAOYSA-N
SMILES:C(NC(OC(C)(C)C)=O)(=N)N1C=NC=N1
Synonyms:
  • 1,1-Dimethylethyl N-(imino-1H-1,2,4-triazol-1-ylmethyl)carbamate
  • Carbamic acid, N-(imino-1H-1,2,4-triazol-1-ylmethyl)-, 1,1-dimethylethyl ester
  • (IMINO-[1,2,4]TRIAZOL-1-YL-METHYL)-CARBAMIC ACID TERT-BUTYL ESTER
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