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CAS 62642-59-5

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4-[(diethylamino)methyl]benzoic acid

Description:
4-[(Diethylamino)methyl]benzoic acid, with the CAS number 62642-59-5, is an organic compound characterized by its aromatic structure and the presence of both a carboxylic acid and a diethylamino group. This compound features a benzoic acid core, which is a benzene ring substituted with a carboxylic acid (-COOH) and a diethylamino group (-N(C2H5)2) attached to a methylene (-CH2-) bridge. The presence of the diethylamino group imparts basic properties to the molecule, making it potentially useful in various applications, including pharmaceuticals and as a pH-sensitive agent. The compound is typically a solid at room temperature and may exhibit solubility in polar solvents due to the carboxylic acid functionality. Its chemical behavior can be influenced by the pH of the environment, affecting its ionization state and, consequently, its reactivity and solubility. Overall, 4-[(diethylamino)methyl]benzoic acid is notable for its dual functional groups, which can participate in various chemical reactions and interactions.
Formula:C12H17NO2
InChI:InChI=1/C12H17NO2/c1-3-13(4-2)9-10-5-7-11(8-6-10)12(14)15/h5-8H,3-4,9H2,1-2H3,(H,14,15)
SMILES:CCN(CC)Cc1ccc(cc1)C(=O)O
Synonyms:
  • benzenemethanaminium, 4-carboxy-N,N-diethyl-, inner salt
  • Benzoic acid, 4-[(diethylamino)methyl]-
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