CAS 390815-47-1

Benzeneacetic acid, α-amino-4-(1-methylethyl)-, methyl ester, hydrochloride (1:1)

Description:

Benzeneacetic acid, α-amino-4-(1-methylethyl)-, methyl ester, hydrochloride (1:1), with the CAS number 390815-47-1, is a chemical compound characterized by its structure, which includes a benzene ring, an acetic acid moiety, and an amino group. This compound is typically a white to off-white crystalline solid, soluble in water and various organic solvents, reflecting its ionic nature due to the hydrochloride form. The presence of the methyl ester group suggests it may exhibit moderate lipophilicity, while the amino group can participate in hydrogen bonding, influencing its reactivity and interaction with biological systems. This compound may be of interest in pharmaceutical research, particularly in the development of drugs targeting specific biological pathways. Its hydrochloride form indicates that it is a salt, which can enhance stability and solubility in aqueous environments. As with many amino acids and their derivatives, it may exhibit properties such as chirality, influencing its biological activity and interactions.

Formula: C₁₂H₁₇NO₂·ClH

InChI: InChI=1S/C12H17NO2.ClH/c1-8(2)9-4-6-10(7-5-9)11(13)12(14)15-3;/h4-8,11H,13H2,1-3H3;1H

InChI key: InChIKey=GHDYGNWWDKUVOG-UHFFFAOYSA-N

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

Synonyms:

• Benzeneacetic acid, α-amino-4-(1-methylethyl)-, methyl ester, hydrochloride
• Benzeneacetic acid, α-amino-4-(1-methylethyl)-, methyl ester, hydrochloride (1:1)

Methyl 2-amino-2-[4-(propan-2-yl)phenyl]acetate hydrochloride

CAS: 390815-47-1

Versatile small molecule scaffold

Formula: C₁₂H₁₈ClNO₂

Purity: Min. 95%

Molecular weight: 243.73 g/mol

Ref: 3D-QQA81547