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CAS 218608-98-1

:

(βR)-β-[[(1,1-Dimethylethoxy)carbonyl]amino]-2-fluorobenzenebutanoic acid

Description:
The chemical substance known as (βR)-β-[[(1,1-Dimethylethoxy)carbonyl]amino]-2-fluorobenzenebutanoic acid, with the CAS number 218608-98-1, is a synthetic organic compound characterized by its complex structure, which includes a fluorinated aromatic ring and an amino acid derivative. This compound features a chiral center, indicated by the (βR) designation, which contributes to its stereochemistry and potential biological activity. The presence of the dimethylethoxycarbonyl group suggests that it may be used as a protecting group in peptide synthesis or other organic reactions. The fluorine atom in the aromatic ring can enhance the compound's lipophilicity and influence its interaction with biological targets. Additionally, the carboxylic acid functional group indicates potential acidity and reactivity, making it relevant in various chemical and pharmaceutical applications. Overall, this compound's unique structural features may confer specific properties that are valuable in medicinal chemistry and drug development.
Formula:C15H20FNO4
InChI:InChI=1S/C15H20FNO4/c1-15(2,3)21-14(20)17-11(9-13(18)19)8-10-6-4-5-7-12(10)16/h4-7,11H,8-9H2,1-3H3,(H,17,20)(H,18,19)/t11-/m1/s1
InChI key:InChIKey=PUMMDCKRQRQFAD-LLVKDONJSA-N
SMILES:[C@H](CC1=C(F)C=CC=C1)(NC(OC(C)(C)C)=O)CC(O)=O
Synonyms:
  • (3R)-3-[(tert-butoxycarbonyl)amino]-4-(2-fluorophenyl)butanoic acid
  • (3R)-[(tert-Butoxycarbonyl)amino]-4-(2-fluorophenyl)butanoic acid
  • (R)-3-[(tert-Butoxycarbonyl)amino]-4-(2-fluorophenyl)butanoic acid
  • (βR)-β-[[(1,1-Dimethylethoxy)carbonyl]amino]-2-fluorobenzenebutanoic acid
  • Benzenebutanoic acid, β-[[(1,1-dimethylethoxy)carbonyl]amino]-2-fluoro-, (βR)-
  • Boc-D-3-Amino-4-(2-fluorophenyl)-butyric acid
  • Boc-D-β-HoPhe(2-F)-OH
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