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CAS 33233-67-9

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4-[(tert-Butoxycarbonylamino)methyl]benzoic acid

Description:
4-[(tert-Butoxycarbonylamino)methyl]benzoic acid, with the CAS number 33233-67-9, is an organic compound characterized by its benzoic acid structure modified with a tert-butoxycarbonyl (Boc) group and an amino methyl substituent. This compound typically appears as a white to off-white solid and is soluble in polar organic solvents. The presence of the Boc group provides protection for the amine functionality, making it useful in peptide synthesis and other organic reactions where selective deprotection is required. The carboxylic acid group contributes to its acidic properties, allowing it to participate in various chemical reactions, including esterification and amidation. Additionally, the compound's structure suggests potential applications in medicinal chemistry, particularly in the development of pharmaceuticals, due to its ability to form hydrogen bonds and interact with biological targets. Overall, 4-[(tert-Butoxycarbonylamino)methyl]benzoic acid is a versatile intermediate in organic synthesis with significant relevance in chemical research and development.
Formula:C13H16NO4
InChI:InChI=1/C13H17NO4/c1-13(2,3)18-12(17)14-8-9-4-6-10(7-5-9)11(15)16/h4-7H,8H2,1-3H3,(H,14,17)(H,15,16)/p-1
SMILES:CC(C)(C)OC(=NCc1ccc(cc1)C(=O)[O-])O
Synonyms:
  • 4-{[(tert-Butoxycarbonyl)amino]methyl}benzoic acid
  • Benzoic Acid, 4-[[[(1,1-Dimethylethoxy)Carbonyl]Amino]Methyl]-
  • 4-{[(Tert-Butoxycarbonyl)Amino]Methyl}Benzoate
  • Boc-4-Amb-OH
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