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CAS 453557-71-6

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Methyl β-amino-4-bromobenzenepropanoate

Description:
Methyl β-amino-4-bromobenzenepropanoate, identified by its CAS number 453557-71-6, is an organic compound characterized by the presence of a bromobenzene ring, an amino group, and an ester functional group. This compound typically exhibits a white to off-white crystalline appearance and is soluble in organic solvents, reflecting its hydrophobic aromatic structure. The presence of the amino group suggests potential basicity and reactivity, particularly in forming salts or participating in nucleophilic reactions. The bromine atom introduces a halogen, which can influence the compound's reactivity and stability, making it a useful intermediate in organic synthesis. Additionally, the methyl ester group contributes to its overall polarity and can affect its biological activity, potentially making it relevant in pharmaceutical applications. Overall, Methyl β-amino-4-bromobenzenepropanoate is a compound of interest in both synthetic organic chemistry and medicinal chemistry due to its unique structural features and functional groups.
Formula:C10H12BrNO2
InChI:InChI=1S/C10H12BrNO2/c1-14-10(13)6-9(12)7-2-4-8(11)5-3-7/h2-5,9H,6,12H2,1H3
InChI key:InChIKey=PNQOPUGACIDGKL-UHFFFAOYSA-N
SMILES:C(CC(OC)=O)(N)C1=CC=C(Br)C=C1
Synonyms:
  • Benzenepropanoic acid, β-amino-4-bromo-, methyl ester
  • Methyl β-amino-4-bromobenzenepropanoate
  • METHYL 3-AMINO-3-(4-BROMOPHENYL)PROPANOATE
  • METHYL-3-AMINO-3-(4-BROMOPHENYL)PROPIONATE
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