CAS 1235439-72-1

Benzoic acid, 4-[methyl(1-methylethyl)amino]-, hydrochloride (1:1)

Description:

Benzoic acid, 4-[methyl(1-methylethyl)amino]-, hydrochloride (1:1) is a chemical compound characterized by its structure, which includes a benzoic acid moiety substituted with a 4-(methyl(1-methylethyl)amino) group. This compound typically appears as a white to off-white crystalline solid and is soluble in water, reflecting its hydrochloride form. The presence of the hydrochloride indicates that it is a salt formed from the reaction of benzoic acid with hydrochloric acid, enhancing its solubility and stability in aqueous environments. The methyl and isopropyl groups contribute to its lipophilicity, which may influence its biological activity and interaction with cellular membranes. This compound may exhibit properties typical of both benzoic acid derivatives and amines, potentially including antimicrobial or antifungal activities, although specific biological effects would depend on further empirical studies. As with many organic compounds, handling should be done with care, following appropriate safety protocols to mitigate any risks associated with exposure.

Formula: C₁₁H₁₅NO₂·ClH

InChI: InChI=1S/C11H15NO2.ClH/c1-8(2)12(3)10-6-4-9(5-7-10)11(13)14;/h4-8H,1-3H3,(H,13,14);1H

InChI key: InChIKey=WVDPPCUJKRQZQQ-UHFFFAOYSA-N

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

Synonyms:

• Benzoic acid, 4-[methyl(1-methylethyl)amino]-, hydrochloride (1:1)

4-[Methyl(propan-2-yl)amino]benzoic acid hydrochloride

CAS: 1235439-72-1

Versatile small molecule scaffold

Formula: C₁₁H₁₆ClNO₂

Purity: Min. 95%

Molecular weight: 229.7 g/mol

Ref: 3D-KZB43972