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CAS 1454906-51-4

:

1,1-Dimethylethyl N-[(5-bromo-1,3,4-thiadiazol-2-yl)methyl]carbamate

Description:
1,1-Dimethylethyl N-[(5-bromo-1,3,4-thiadiazol-2-yl)methyl]carbamate, identified by its CAS number 1454906-51-4, is a chemical compound that features a carbamate functional group, which is characterized by the presence of a carbonyl group (C=O) bonded to a nitrogen atom (N) that is also connected to an alkyl or aryl group. This specific compound includes a 5-bromo-1,3,4-thiadiazole moiety, which contributes to its biological activity and potential applications in agrochemicals or pharmaceuticals. The presence of the dimethyl group indicates steric hindrance, which can influence the compound's reactivity and solubility. Additionally, the bromine atom may enhance the compound's lipophilicity and biological interactions. Overall, the unique combination of functional groups and substituents in this molecule suggests potential utility in various chemical applications, particularly in the development of herbicides or insecticides, although specific properties such as solubility, stability, and toxicity would require further investigation through empirical studies.
Formula:C8H12BrN3O2S
InChI:InChI=1S/C8H12BrN3O2S/c1-8(2,3)14-7(13)10-4-5-11-12-6(9)15-5/h4H2,1-3H3,(H,10,13)
InChI key:InChIKey=GAMAMLTWNYNACZ-UHFFFAOYSA-N
SMILES:C(NC(OC(C)(C)C)=O)C=1SC(Br)=NN1
Synonyms:
  • 1,1-Dimethylethyl N-[(5-bromo-1,3,4-thiadiazol-2-yl)methyl]carbamate
  • Carbamic acid, N-[(5-bromo-1,3,4-thiadiazol-2-yl)methyl]-, 1,1-dimethylethyl ester
  • tert-Butyl [(5-bromo-1,3,4-thiadiazol-2-yl)methyl]carbamate
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