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CAS 5442-91-1

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4-(Ethoxycarbonyl)-3,5-dimethyl-1H-pyrrole-2-carboxylic acid

Description:
4-(Ethoxycarbonyl)-3,5-dimethyl-1H-pyrrole-2-carboxylic acid is an organic compound characterized by its pyrrole ring structure, which is a five-membered aromatic heterocycle containing nitrogen. This compound features two distinct functional groups: an ethoxycarbonyl group and a carboxylic acid group, contributing to its reactivity and solubility properties. The presence of methyl groups at the 3 and 5 positions of the pyrrole ring enhances its hydrophobic characteristics while also influencing its electronic properties. The ethoxycarbonyl moiety provides a site for potential nucleophilic attack, making it useful in various synthetic applications. This compound is typically a solid at room temperature and may exhibit moderate solubility in polar organic solvents. Its chemical behavior can be influenced by the acidity of the carboxylic acid group, which can participate in hydrogen bonding and affect its interactions with other molecules. Overall, this compound is of interest in organic synthesis and may have applications in pharmaceuticals or agrochemicals due to its unique structural features.
Formula:C10H12NO4
InChI:InChI=1/C10H13NO4/c1-4-15-10(14)7-5(2)8(9(12)13)11-6(7)3/h11H,4H2,1-3H3,(H,12,13)/p-1
SMILES:CCOC(=O)c1c(C)c(C(=O)[O-])[nH]c1C
Synonyms:
  • 1H-Pyrrole-2,4-dicarboxylic acid, 3,5-dimethyl-, 4-ethyl ester
  • 4-(ethoxycarbonyl)-3,5-dimethyl-1H-pyrrole-2-carboxylate
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