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CAS 412925-12-3

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β-Amino-2,3-dimethylbenzenepropanoic acid

Description:
β-Amino-2,3-dimethylbenzenepropanoic acid, also known by its CAS number 412925-12-3, is an organic compound characterized by the presence of an amino group and a carboxylic acid functional group, which classifies it as an amino acid derivative. This compound features a benzene ring substituted with two methyl groups at the 2 and 3 positions, contributing to its hydrophobic characteristics. The propanoic acid moiety provides acidity, while the amino group imparts basicity, making it a zwitterionic compound in solution. Its structural features suggest potential applications in pharmaceuticals, particularly in the development of drugs that target specific biological pathways. The compound's solubility, stability, and reactivity can be influenced by the presence of the methyl groups and the functional groups, which may also affect its interaction with biological systems. Overall, β-Amino-2,3-dimethylbenzenepropanoic acid is of interest in both synthetic organic chemistry and medicinal chemistry due to its unique structural properties.
Formula:C11H15NO2
InChI:InChI=1S/C11H15NO2/c1-7-4-3-5-9(8(7)2)10(12)6-11(13)14/h3-5,10H,6,12H2,1-2H3,(H,13,14)
InChI key:InChIKey=LFLCQYMIXBDOQL-UHFFFAOYSA-N
SMILES:C(CC(O)=O)(N)C1=C(C)C(C)=CC=C1
Synonyms:
  • β-Amino-2,3-dimethylbenzenepropanoic acid
  • Benzenepropanoic acid, β-amino-2,3-dimethyl-
  • 3-Amino-3-(2,3-dimethylphenyl)propanoic acid
  • 3-Amino-3-(2,3-dimethyl-phenyl)-propionic acid
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