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CAS 479064-97-6

:

(βR)-β-[[(1,1-Dimethylethoxy)carbonyl]amino]-4-methylbenzenepropanoic acid

Description:
The chemical substance known as (βR)-β-[[(1,1-Dimethylethoxy)carbonyl]amino]-4-methylbenzenepropanoic acid, with the CAS number 479064-97-6, is a synthetic organic compound characterized by its complex structure, which includes an amino acid derivative. This compound features a β-amino acid framework, incorporating a dimethylethoxycarbonyl protecting group that enhances its stability and solubility. The presence of a 4-methylbenzene moiety contributes to its hydrophobic characteristics, while the propanoic acid functional group imparts acidic properties. The stereochemistry indicated by (βR) suggests a specific spatial arrangement of atoms, which can influence the compound's biological activity and interactions. Such compounds are often studied for their potential applications in pharmaceuticals, particularly in drug design and development, due to their ability to mimic natural amino acids and peptides. Overall, this compound exemplifies the intricate relationship between molecular structure and function in organic chemistry.
Formula:C15H21NO4
InChI:InChI=1S/C15H21NO4/c1-10-5-7-11(8-6-10)12(9-13(17)18)16-14(19)20-15(2,3)4/h5-8,12H,9H2,1-4H3,(H,16,19)(H,17,18)/t12-/m1/s1
InChI key:InChIKey=MBWMIEZHOLGJBM-GFCCVEGCSA-N
SMILES:[C@@H](NC(OC(C)(C)C)=O)(CC(O)=O)C1=CC=C(C)C=C1
Synonyms:
  • (3R)-3-[[(tert-Butoxy)carbonyl]amino]-3-(4-methylphenyl)propanoic acid
  • (R)-3-((tert-Butoxycarbonyl)amino)-3-(p-tolyl)propanoicacid
  • (βR)-β-[[(1,1-Dimethylethoxy)carbonyl]amino]-4-methylbenzenepropanoic acid
  • Benzenepropanoic acid, β-[[(1,1-dimethylethoxy)carbonyl]amino]-4-methyl-, (βR)-
  • Boc-?-R-4-Methylphenylalanine
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