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CAS 15029-53-5

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4-(2-Cyano-acetylamino)-benzoic acid ethyl ester

Description:
4-(2-Cyano-acetylamino)-benzoic acid ethyl ester, with the CAS number 15029-53-5, is an organic compound characterized by its functional groups, which include an ester, an amine, and a cyano group. This compound typically appears as a solid or crystalline substance and is soluble in organic solvents, reflecting its ester functionality. The presence of the cyano group contributes to its reactivity, making it a potential candidate for various chemical reactions, including nucleophilic additions. The benzoic acid moiety provides aromatic stability, while the ethyl ester enhances its lipophilicity, which can influence its biological activity and solubility in different environments. This compound may be utilized in synthetic organic chemistry, particularly in the development of pharmaceuticals or agrochemicals, due to its diverse functional groups that can participate in further chemical transformations. Safety data should be consulted for handling and storage, as compounds with cyano groups can pose toxicity risks.
Formula:C12H12N2O3
InChI:InChI=1/C12H12N2O3/c1-2-17-12(16)9-3-5-10(6-4-9)14-11(15)7-8-13/h3-6H,2,7H2,1H3,(H,14,15)
SMILES:CCOC(=O)c1ccc(cc1)NC(=O)CC#N
Synonyms:
  • Benzoic acid, 4-[(2-cyanoacetyl)amino]-, ethyl ester
  • Ethyl 4-[(cyanoacetyl)amino]benzoate
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