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CAS 1414958-19-2

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1,1-Dimethylethyl 1-cyanocyclopropanecarboxylate

Description:
1,1-Dimethylethyl 1-cyanocyclopropanecarboxylate, identified by its CAS number 1414958-19-2, is an organic compound characterized by its unique structure that includes a cyclopropane ring and a cyano group. This compound features a tert-butyl group (1,1-dimethylethyl) attached to a cyclopropanecarboxylate moiety, which contributes to its reactivity and potential applications in organic synthesis. The presence of the cyano group enhances its utility in various chemical reactions, including nucleophilic additions and cycloadditions. Typically, compounds of this nature exhibit moderate polarity due to the presence of both hydrophobic alkyl groups and polar functional groups, influencing their solubility in organic solvents. Additionally, the compound may exhibit interesting biological activities, making it a candidate for further research in medicinal chemistry. Its stability and reactivity can vary based on environmental conditions, such as temperature and pH, which are important considerations in its handling and application in laboratory settings.
Formula:C9H13NO2
InChI:InChI=1S/C9H13NO2/c1-8(2,3)12-7(11)9(6-10)4-5-9/h4-5H2,1-3H3
InChI key:InChIKey=MKWBPXNKDXMTRP-UHFFFAOYSA-N
SMILES:C(OC(C)(C)C)(=O)C1(C#N)CC1
Synonyms:
  • 1-Cyano-cyclopropanecarboxylic acid tert-butyl ester
  • Cyclopropanecarboxylic acid, 1-cyano-, 1,1-dimethylethyl ester
  • 1,1-Dimethylethyl 1-cyanocyclopropanecarboxylate
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