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CAS 611238-94-9

:

1,1-Dimethylethyl 1H-imidazole-5-carboxylate

Description:
1,1-Dimethylethyl 1H-imidazole-5-carboxylate, with the CAS number 611238-94-9, is an organic compound characterized by its imidazole ring structure, which is a five-membered heterocyclic compound containing two nitrogen atoms. This substance features a carboxylate functional group, contributing to its potential reactivity and solubility in various solvents. The presence of the tert-butyl group (1,1-dimethylethyl) enhances its steric bulk, which can influence its chemical behavior and interactions with other molecules. Typically, compounds like this may exhibit properties such as moderate polarity, making them soluble in polar organic solvents. They may also participate in various chemical reactions, including esterification and nucleophilic substitutions, due to the presence of the carboxylate group. Additionally, the imidazole moiety is known for its biological significance, often found in various natural products and pharmaceuticals, suggesting potential applications in medicinal chemistry. Overall, this compound's unique structure and functional groups make it of interest in both synthetic and applied chemistry contexts.
Formula:C8H12N2O2
InChI:InChI=1S/C8H12N2O2/c1-8(2,3)12-7(11)6-4-9-5-10-6/h4-5H,1-3H3,(H,9,10)
InChI key:InChIKey=BOCWGBMVJKSUOD-UHFFFAOYSA-N
SMILES:C(OC(C)(C)C)(=O)C1=CN=CN1
Synonyms:
  • 1H-Imidazole-5-carboxylic acid, 1,1-dimethylethyl ester
  • 1H-Imidazole-4-carboxylic acid, 1,1-dimethylethyl ester
  • tert-Butyl 1H-imidazole-4-carboxylate
  • 1,1-Dimethylethyl 1H-imidazole-5-carboxylate
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