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CAS 132690-91-6

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4-(2-BOC-AMINOETHYL)BENZOIC ACID

Description:
4-(2-BOC-Aminoethyl)benzoic acid, with the CAS number 132690-91-6, is a chemical compound characterized by its structure, which includes a benzoic acid moiety substituted with a 2-Boc-aminoethyl group. The "Boc" (tert-butyloxycarbonyl) group serves as a protective group for the amino functionality, making it useful in peptide synthesis and other organic reactions. This compound typically appears as a white to off-white solid and is soluble in organic solvents such as dimethyl sulfoxide (DMSO) and dimethylformamide (DMF), but may have limited solubility in water. Its molecular structure contributes to its potential applications in medicinal chemistry, particularly in the development of pharmaceuticals. The presence of both the carboxylic acid and the amino group allows for various chemical modifications, making it versatile in synthetic organic chemistry. Safety data should be consulted for handling and storage, as with any chemical substance, to ensure proper laboratory practices are followed.
Formula:C14H19NO4
InChI:InChI=1/C14H19NO4/c1-14(2,3)19-13(18)15-9-8-10-4-6-11(7-5-10)12(16)17/h4-7H,8-9H2,1-3H3,(H,15,18)(H,16,17)
SMILES:CC(C)(C)OC(=NCCc1ccc(cc1)C(=O)O)O
Synonyms:
  • Benzoic Acid, 4-[2-[[(1,1-Dimethylethoxy)Carbonyl]Amino]Ethyl]-
  • 4-{2-[(Tert-Butoxycarbonyl)Amino]Ethyl}Benzoic Acid
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