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CAS 270062-90-3

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(βS)-β-[[(1,1-Dimethylethoxy)carbonyl]amino]-2-methylbenzenebutanoic acid

Description:
The chemical substance known as (βS)-β-[[(1,1-Dimethylethoxy)carbonyl]amino]-2-methylbenzenebutanoic acid, with the CAS number 270062-90-3, is a synthetic organic compound characterized by its complex structure, which includes a chiral center, an amino group, and a carboxylic acid functional group. This compound is likely to exhibit properties typical of amino acids, such as the ability to form hydrogen bonds and participate in various chemical reactions due to its functional groups. The presence of the dimethylethoxycarbonyl group suggests that it may be used as a protecting group in peptide synthesis or other organic reactions. Additionally, the 2-methylbenzene moiety indicates potential aromatic interactions, which could influence its solubility and reactivity. The stereochemistry (βS) implies specific spatial arrangements that can affect biological activity, making it of interest in pharmaceutical applications. Overall, this compound's unique features make it a subject of interest in organic synthesis and medicinal chemistry.
Formula:C16H23NO4
InChI:InChI=1S/C16H23NO4/c1-11-7-5-6-8-12(11)9-13(10-14(18)19)17-15(20)21-16(2,3)4/h5-8,13H,9-10H2,1-4H3,(H,17,20)(H,18,19)/t13-/m0/s1
InChI key:InChIKey=USTHBHOCUVYEFP-ZDUSSCGKSA-N
SMILES:[C@@H](CC1=C(C)C=CC=C1)(NC(OC(C)(C)C)=O)CC(O)=O
Synonyms:
  • (3S)-3-[(tert-butoxycarbonyl)amino]-4-(2-methylphenyl)butanoic acid
  • (βS)-β-[[(1,1-Dimethylethoxy)carbonyl]amino]-2-methylbenzenebutanoic acid
  • Benzenebutanoic acid, β-[[(1,1-dimethylethoxy)carbonyl]amino]-2-methyl-, (βS)-
  • Boc-L-3-Amino-4-(2-methylphenyl)-butyric acid
  • Boc-β-HoPhe(2-Me)-OH
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