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CAS 850374-95-7

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1-tert-butyl 6-methyl 3-formyl-1H-indole-1,6-dicarboxylate

Description:
1-tert-butyl 6-methyl 3-formyl-1H-indole-1,6-dicarboxylate, with the CAS number 850374-95-7, is a synthetic organic compound belonging to the indole family. This compound features a complex structure characterized by an indole ring, which is a bicyclic structure composed of a benzene ring fused to a pyrrole ring. The presence of tert-butyl and methyl groups contributes to its hydrophobic characteristics, while the formyl and dicarboxylate functionalities introduce polar groups that can engage in hydrogen bonding and other interactions. This compound is likely to exhibit interesting chemical reactivity due to the presence of the formyl group, which can participate in various reactions such as condensation and nucleophilic addition. Additionally, the dicarboxylate moiety may influence its solubility and reactivity in different solvents. The compound's unique structure suggests potential applications in medicinal chemistry, particularly in the development of pharmaceuticals or agrochemicals, although specific biological activities would require further investigation.
Formula:C16H17NO5
InChI:InChI=1/C16H17NO5/c1-16(2,3)22-15(20)17-8-11(9-18)12-6-5-10(7-13(12)17)14(19)21-4/h5-9H,1-4H3
SMILES:CC(C)(C)OC(=O)n1cc(C=O)c2ccc(cc12)C(=O)OC
Synonyms:
  • 3-FORMYL-6-(METHOXYCARBONYL)-1H-INDOLE, N-BOC PROTECTED
  • 1-TERT-BUTYL 6-METHYL 3-FORMYL-1H-INDOLE-1,6-DICARBOXYLATE
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