CAS 91090-95-8
:Ethyl 6-nitro-1H-indole-3-carboxylate
Description:
Ethyl 6-nitro-1H-indole-3-carboxylate is a chemical compound characterized by its indole structure, which is a bicyclic compound consisting of a benzene ring fused to a pyrrole ring. The presence of a nitro group at the 6-position and an ethyl ester at the 3-carboxylate position contributes to its unique reactivity and properties. This compound typically appears as a yellow to orange solid and is soluble in organic solvents such as ethanol and dichloromethane, but may have limited solubility in water. Ethyl 6-nitro-1H-indole-3-carboxylate is often utilized in organic synthesis, particularly in the development of pharmaceuticals and agrochemicals, due to its ability to undergo various chemical transformations. Its nitro group can participate in reduction reactions, while the carboxylate can engage in esterification or amidation reactions. As with many nitro compounds, it is important to handle this substance with care, as it may pose health risks if ingested or inhaled, and appropriate safety measures should be observed during its use.
Formula:C11H10N2O4
InChI:InChI=1S/C11H10N2O4/c1-2-17-11(14)9-6-12-10-5-7(13(15)16)3-4-8(9)10/h3-6,12H,2H2,1H3
InChI key:InChIKey=SLHPWWZFMQHSFY-UHFFFAOYSA-N
SMILES:C(OCC)(=O)C=1C=2C(=CC(N(=O)=O)=CC2)NC1
Synonyms:- 1H-Indole-3-carboxylic acid, 6-nitro-, ethyl ester
- Ethyl 6-nitro-1H-indole-3-carboxylate
- Indole-3-carboxylic acid, 6-nitro-, ethyl ester
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