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CAS 502842-02-6

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Benzenepropanoic acid, β-amino-2,4-dichloro-, ethyl ester, hydrochloride (1:1)

Description:
Benzenepropanoic acid, β-amino-2,4-dichloro-, ethyl ester, hydrochloride (1:1) is a chemical compound characterized by its structural features, which include a benzene ring, a propanoic acid moiety, and a β-amino group with dichloro substitutions. The presence of the ethyl ester indicates that the carboxylic acid group is esterified with an ethyl group, enhancing its lipophilicity and potentially influencing its biological activity. The hydrochloride form suggests that the compound is a salt, which can improve its solubility in aqueous solutions, making it more suitable for pharmaceutical applications. The dichloro substituents on the aromatic ring may impart specific reactivity and biological properties, possibly affecting its interaction with biological targets. This compound may be of interest in medicinal chemistry due to its potential pharmacological effects, although specific biological activities would require further investigation. As with many chemical substances, safety data and handling precautions should be considered, particularly due to the presence of chlorine atoms, which can pose environmental and health risks.
Formula:C11H13Cl2NO2·ClH
InChI:InChI=1S/C11H13Cl2NO2.ClH/c1-2-16-11(15)6-10(14)8-4-3-7(12)5-9(8)13;/h3-5,10H,2,6,14H2,1H3;1H
InChI key:InChIKey=FZDCBTFZCCIEDO-UHFFFAOYSA-N
SMILES:C(CC(OCC)=O)(N)C1=C(Cl)C=C(Cl)C=C1.Cl
Synonyms:
  • Benzenepropanoic acid, β-amino-2,4-dichloro-, ethyl ester, hydrochloride (1:1)
  • Benzenepropanoic acid, β-amino-2,4-dichloro-, ethyl ester, hydrochloride
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