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CAS 893612-97-0

:

3-amino-2-[(3,5-dimethylphenyl)amino]benzoic acid

Description:
3-Amino-2-[(3,5-dimethylphenyl)amino]benzoic acid, identified by its CAS number 893612-97-0, is an organic compound characterized by its amino and carboxylic acid functional groups, which contribute to its properties as an amino acid derivative. This compound features a benzoic acid core with an amino group at the 3-position and a substituted aniline moiety at the 2-position, specifically a 3,5-dimethylphenyl group. The presence of these functional groups suggests that it may exhibit both acidic and basic characteristics, allowing it to participate in various chemical reactions, including hydrogen bonding and potential interactions with biological systems. Its structure indicates potential applications in pharmaceuticals, particularly in drug design, due to the presence of the amino and carboxylic acid groups, which can enhance solubility and bioactivity. Additionally, the dimethyl substitution on the phenyl ring may influence its steric and electronic properties, affecting its reactivity and interaction with other molecules. Overall, this compound's unique structure positions it as a candidate for further research in medicinal chemistry and related fields.
Formula:C15H16N2O2
InChI:InChI=1/C15H16N2O2/c1-9-6-10(2)8-11(7-9)17-14-12(15(18)19)4-3-5-13(14)16/h3-8,17H,16H2,1-2H3,(H,18,19)
SMILES:Cc1cc(C)cc(c1)Nc1c(cccc1N)C(=O)O
Synonyms:
  • Benzoic Acid, 3-Amino-2-[(3,5-Dimethylphenyl)Amino]-
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