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CAS 937046-96-3

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1,1-Dimethylethyl N-(2-cyano-1H-pyrrol-1-yl)carbamate

Description:
1,1-Dimethylethyl N-(2-cyano-1H-pyrrol-1-yl)carbamate, with the CAS number 937046-96-3, is a chemical compound that belongs to the class of carbamates. It features a dimethyl group attached to a tert-butyl moiety, which contributes to its steric bulk and potentially influences its reactivity and solubility. The presence of a cyano group and a pyrrole ring indicates that this compound may exhibit interesting electronic properties and biological activity, making it of interest in medicinal chemistry and agrochemical applications. The carbamate functional group suggests that it may act as a reversible inhibitor of certain enzymes, particularly those involved in neurotransmission or pest control. Its stability and reactivity can be influenced by environmental factors such as pH and temperature. Overall, this compound's unique structure may lead to diverse applications, although specific characteristics such as solubility, melting point, and toxicity would require empirical data for a comprehensive understanding.
Formula:C10H13N3O2
InChI:InChI=1S/C10H13N3O2/c1-10(2,3)15-9(14)12-13-6-4-5-8(13)7-11/h4-6H,1-3H3,(H,12,14)
InChI key:InChIKey=SXUSNFHKHIJDRN-UHFFFAOYSA-N
SMILES:N(C(OC(C)(C)C)=O)N1C(C#N)=CC=C1
Synonyms:
  • 1,1-Dimethylethyl N-(2-cyano-1H-pyrrol-1-yl)carbamate
  • tert-Butyl (2-cyano-1H-pyrrol-1-yl)carbamate
  • Carbamic acid, N-(2-cyano-1H-pyrrol-1-yl)-, 1,1-dimethylethyl ester
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