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CAS 882188-88-7

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1,1-Dimethylethyl 3-formyl-1H-indazole-1-carboxylate

Description:
1,1-Dimethylethyl 3-formyl-1H-indazole-1-carboxylate, identified by its CAS number 882188-88-7, is a chemical compound that features a complex structure typical of indazole derivatives. This substance contains an indazole ring, which is a five-membered aromatic heterocycle, and is substituted with a formyl group and a carboxylate moiety. The presence of the tert-butyl group (1,1-dimethylethyl) enhances its lipophilicity, potentially affecting its solubility and reactivity. The formyl group indicates that it can participate in various chemical reactions, such as condensation or oxidation, making it a versatile intermediate in organic synthesis. Additionally, the carboxylate group may impart acidic properties, influencing the compound's behavior in different pH environments. Overall, this compound's unique structural features suggest potential applications in medicinal chemistry, particularly in the development of pharmaceuticals or agrochemicals, although specific biological activities would require further investigation.
Formula:C13H14N2O3
InChI:InChI=1S/C13H14N2O3/c1-13(2,3)18-12(17)15-11-7-5-4-6-9(11)10(8-16)14-15/h4-8H,1-3H3
InChI key:InChIKey=NURJOQOCJSRMHF-UHFFFAOYSA-N
SMILES:C(OC(C)(C)C)(=O)N1C=2C(C(C=O)=N1)=CC=CC2
Synonyms:
  • 1,1-Dimethylethyl 3-formyl-1H-indazole-1-carboxylate
  • 1H-Indazole-1-carboxylic acid, 3-formyl-, 1,1-dimethylethyl ester
  • tert-Butyl 3-formyl-1H-indazole-1-carboxylate
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