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CAS 499995-73-2

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3-[(tert-butoxycarbonyl)amino]-3-(4-nitrophenyl)propanoic acid

Description:
3-[(tert-butoxycarbonyl)amino]-3-(4-nitrophenyl)propanoic acid is an organic compound characterized by its complex structure, which includes a propanoic acid backbone, a tert-butoxycarbonyl (Boc) protecting group, and a 4-nitrophenyl substituent. The presence of the Boc group indicates that this compound is likely used in peptide synthesis, as it serves to protect the amino group during chemical reactions. The 4-nitrophenyl group introduces an electron-withdrawing nitro group, which can enhance the compound's reactivity and influence its solubility and polarity. This compound is typically a solid at room temperature and may exhibit moderate solubility in polar solvents due to the presence of the carboxylic acid functional group. Its molecular structure suggests potential applications in medicinal chemistry, particularly in the development of pharmaceuticals or as intermediates in organic synthesis. Safety and handling precautions should be observed, as compounds containing nitro groups can be hazardous.
Formula:C14H18N2O6
InChI:InChI=1/C14H18N2O6/c1-14(2,3)22-13(19)15-11(8-12(17)18)9-4-6-10(7-5-9)16(20)21/h4-7,11H,8H2,1-3H3,(H,15,19)(H,17,18)
SMILES:CC(C)(C)OC(=NC(CC(=O)O)c1ccc(cc1)N(=O)=O)O
Synonyms:
  • (3S)-3-({[(2-Methyl-2-propanyl)oxy]carbonyl}amino)-3-(4-nitrophenyl)propanoic acid
  • Benzenepropanoic Acid, Beta-[[(1,1-Dimethylethoxy)Carbonyl]Amino]-4-Nitro-
  • benzenepropanoic acid, beta-[[(1,1-dimethylethoxy)carbonyl]amino]-4-nitro-, (betaS)-
  • Boc-(R)-3-Amino-3-(4-nitrophenyl)-propionic acid
  • Boc-(S)-3-Amino-3-(4-nitrophenyl)-propionic acid
  • (R)-3-Boc-Amino-3-(4-Nitrophenyl)Propionic Acid
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