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CAS 669713-65-9

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2-[(tert-butoxycarbonyl)(phenyl)amino]benzoic acid

Description:
2-[(tert-butoxycarbonyl)(phenyl)amino]benzoic acid, identified by its CAS number 669713-65-9, is an organic compound characterized by the presence of both an amino group and a carboxylic acid group, making it an amino acid derivative. The tert-butoxycarbonyl (Boc) group serves as a protective group for the amino functionality, which is commonly used in peptide synthesis and organic synthesis to prevent unwanted reactions. The phenyl group attached to the amino nitrogen contributes to the compound's hydrophobic characteristics, influencing its solubility and reactivity. The benzoic acid moiety provides acidity and can participate in hydrogen bonding, enhancing its potential interactions in biological systems. This compound is typically utilized in pharmaceutical research and development, particularly in the synthesis of more complex molecules. Its structural features suggest potential applications in medicinal chemistry, where modifications can lead to compounds with specific biological activities. Overall, the compound's unique combination of functional groups makes it a valuable intermediate in organic synthesis.
Formula:C18H19NO4
InChI:InChI=1/C18H19NO4/c1-18(2,3)23-17(22)19(13-9-5-4-6-10-13)15-12-8-7-11-14(15)16(20)21/h4-12H,1-3H3,(H,20,21)
SMILES:CC(C)(C)OC(=O)N(c1ccccc1)c1ccccc1C(=O)O
Synonyms:
  • Benzoic acid, 2-[[(1,1-dimethylethoxy)carbonyl]phenylamino]-
  • 2-[(tert-Butoxycarbonyl)(phenyl)amino]benzoic acid
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