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CAS 454473-83-7

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β-[[(1,1-Dimethylethoxy)carbonyl]amino]-4-(methylthio)benzenepropanoic acid

Description:
β-[[(1,1-Dimethylethoxy)carbonyl]amino]-4-(methylthio)benzenepropanoic acid, with CAS number 454473-83-7, is a chemical compound characterized by its complex structure, which includes an amino acid backbone modified with a dimethylethoxycarbonyl group and a methylthio substituent on the aromatic ring. This compound typically exhibits properties associated with amino acids, such as the ability to form hydrogen bonds and participate in various chemical reactions due to the presence of both acidic (carboxylic acid) and basic (amino) functional groups. The dimethylethoxycarbonyl group serves as a protecting group, enhancing the compound's stability and solubility in organic solvents. The methylthio group can influence the compound's reactivity and biological activity, potentially affecting its interactions in biochemical pathways. Overall, this compound may be of interest in pharmaceutical research and development, particularly in the synthesis of biologically active molecules or as a building block in peptide synthesis.
Formula:C15H21NO4S
InChI:InChI=1S/C15H21NO4S/c1-15(2,3)20-14(19)16-12(9-13(17)18)10-5-7-11(21-4)8-6-10/h5-8,12H,9H2,1-4H3,(H,16,19)(H,17,18)
InChI key:InChIKey=NNEZAROGWHIRJI-UHFFFAOYSA-N
SMILES:C(NC(OC(C)(C)C)=O)(CC(O)=O)C1=CC=C(SC)C=C1
Synonyms:
  • Benzenepropanoic acid, β-[[(1,1-dimethylethoxy)carbonyl]amino]-4-(methylthio)-
  • β-[[(1,1-Dimethylethoxy)carbonyl]amino]-4-(methylthio)benzenepropanoic acid
  • 3-((Tert-butoxycarbonyl)amino)-3-(4-(methylthio)phenyl)propanoic acid
  • 3-[(TERT-BUTOXYCARBONYL)AMINO]-3-[4-(METHYLSULFANYL)PHENYL]PROPANOIC ACID
  • 3-N-BOC-3-(4-METHYLTHIOPHENYL)PROPIONIC ACID
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