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CAS 1258640-06-0

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Benzenepropanoic acid, α-(aminomethyl)-2-methyl-, methyl ester, hydrochloride (1:1)

Description:
Benzenepropanoic acid, α-(aminomethyl)-2-methyl-, methyl ester, hydrochloride (1:1), commonly referred to as a hydrochloride salt, is a chemical compound characterized by its structural components that include a benzene ring, a propanoic acid moiety, and an amino group. This compound typically exhibits properties associated with both aromatic and aliphatic compounds, such as moderate solubility in polar solvents due to the presence of the hydrochloride group, which enhances its ionic character. The presence of the amino group suggests potential basicity, while the methyl ester indicates that it can undergo hydrolysis to release the corresponding acid. Its molecular structure allows for various interactions, including hydrogen bonding, which can influence its reactivity and biological activity. This compound may be of interest in pharmaceutical applications, particularly in drug design, due to its potential to interact with biological targets. As with many hydrochloride salts, it is likely to be more stable and easier to handle than its free base form. Safety data and handling precautions should be consulted, as with all chemical substances.
Formula:C12H17NO2·ClH
InChI:InChI=1S/C12H17NO2.ClH/c1-9-5-3-4-6-10(9)7-11(8-13)12(14)15-2;/h3-6,11H,7-8,13H2,1-2H3;1H
InChI key:InChIKey=BAEYVZZRSXQLCB-UHFFFAOYSA-N
SMILES:C(C(C(OC)=O)CN)C1=C(C)C=CC=C1.Cl
Synonyms:
  • Benzenepropanoic acid, α-(aminomethyl)-2-methyl-, methyl ester, hydrochloride (1:1)
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