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CAS 1258651-97-6

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Benzenepropanoic acid, α-(aminomethyl)-4-methyl-, methyl ester, hydrochloride (1:1)

Description:
Benzenepropanoic acid, α-(aminomethyl)-4-methyl-, methyl ester, hydrochloride (1:1), commonly referred to as a derivative of phenylpropanoic acid, is a chemical compound characterized by its aromatic structure and the presence of both an amino group and a carboxylic acid moiety. This compound typically exhibits properties associated with both amines and carboxylic acids, such as solubility in polar solvents due to the presence of the hydrochloride salt form, which enhances its stability and bioavailability. The methyl ester group contributes to its lipophilicity, potentially influencing its pharmacokinetic properties. The presence of the amino group suggests potential for hydrogen bonding, which can affect its reactivity and interaction with biological systems. As a hydrochloride salt, it is likely to be a white crystalline solid, and its synthesis may involve standard organic reactions such as esterification and amination. This compound may have applications in pharmaceuticals or biochemistry, particularly in the development of drugs targeting specific biological pathways. However, specific biological activity and safety profiles would require further investigation.
Formula:C12H17NO2·ClH
InChI:InChI=1S/C12H17NO2.ClH/c1-9-3-5-10(6-4-9)7-11(8-13)12(14)15-2;/h3-6,11H,7-8,13H2,1-2H3;1H
InChI key:InChIKey=LQBZCEFPWPHOFV-UHFFFAOYSA-N
SMILES:C(C(C(OC)=O)CN)C1=CC=C(C)C=C1.Cl
Synonyms:
  • Benzenepropanoic acid, α-(aminomethyl)-4-methyl-, methyl ester, hydrochloride (1:1)
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