CAS 916766-98-8

Benzoic acid, 3-amino-5-hydroxy-, methyl ester, hydrochloride (1:1)

Description:

Benzoic acid, 3-amino-5-hydroxy-, methyl ester, hydrochloride (1:1), with the CAS number 916766-98-8, is a chemical compound characterized by its structural features that include a benzoic acid moiety substituted with an amino group and a hydroxy group, along with a methyl ester functional group. This compound is typically encountered as a hydrochloride salt, which enhances its solubility in water and may influence its biological activity. The presence of the amino and hydroxy groups suggests potential for hydrogen bonding, which can affect its reactivity and interactions with other molecules. As a methyl ester, it may exhibit different properties compared to its free acid form, including variations in lipophilicity and stability. This compound may be of interest in pharmaceutical research due to its potential biological activities, including antimicrobial or anti-inflammatory properties. However, specific applications and effects would depend on further studies and context within medicinal chemistry. Safety data and handling precautions should be consulted when working with this substance.

Formula: C₈H₉NO₃·ClH

InChI: InChI=1S/C8H9NO3.ClH/c1-12-8(11)5-2-6(9)4-7(10)3-5;/h2-4,10H,9H2,1H3;1H

InChI key: InChIKey=HYTDXYUDWMOCQD-UHFFFAOYSA-N

SMILES: C(OC)(=O)C1=CC(N)=CC(O)=C1.Cl

Synonyms:

• Benzoic acid, 3-amino-5-hydroxy-, methyl ester, hydrochloride (1:1)