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CAS 261363-54-6

:

2-(Ethoxycarbonyl)-5-nitro-1H-indole-3-propanoic acid

Description:
2-(Ethoxycarbonyl)-5-nitro-1H-indole-3-propanoic acid, with the CAS number 261363-54-6, is a chemical compound that features an indole core, which is a bicyclic structure composed of a benzene ring fused to a pyrrole ring. This compound is characterized by the presence of an ethoxycarbonyl group and a nitro group, which contribute to its reactivity and potential applications in organic synthesis and medicinal chemistry. The ethoxycarbonyl group enhances its solubility in organic solvents, while the nitro group can participate in various chemical reactions, including reduction and nucleophilic substitution. The presence of a carboxylic acid functional group also indicates that it can act as an acid, potentially participating in acid-base reactions. Overall, this compound may exhibit interesting biological activities, making it a candidate for further research in drug development or as a building block in synthetic organic chemistry. Its specific properties, such as melting point, solubility, and reactivity, would need to be determined through experimental characterization.
Formula:C14H14N2O6
InChI:InChI=1S/C14H14N2O6/c1-2-22-14(19)13-9(4-6-12(17)18)10-7-8(16(20)21)3-5-11(10)15-13/h3,5,7,15H,2,4,6H2,1H3,(H,17,18)
InChI key:InChIKey=BYXCTCGGFZUSEQ-UHFFFAOYSA-N
SMILES:C(CC(O)=O)C=1C=2C(NC1C(OCC)=O)=CC=C(N(=O)=O)C2
Synonyms:
  • 2-(Ethoxycarbonyl)-5-nitro-1H-indole-3-propanoic acid
  • 1H-Indole-3-propanoic acid, 2-(ethoxycarbonyl)-5-nitro-
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