4-(2-aminopyrimidin-5-yl)benzoic acid
$300.00
CAS No.: 222987-21-5
Catalog No.: 196417
Purity: 95%
MF: C11H9N3O2
MW: 215.212
Storage: 2-8 degree Celsius
SMILES: NC1=NC=C(C=N1)C1=CC=C(C(=O)O)C=C1
Catalog No.: 196417
Purity: 95%
MF: C11H9N3O2
MW: 215.212
Storage: 2-8 degree Celsius
SMILES: NC1=NC=C(C=N1)C1=CC=C(C(=O)O)C=C1
4-(2-aminopyrimidin-5-yl)benzoic acid; CAS No.: 222987-21-5; 4-(2-aminopyrimidin-5-yl)benzoic acid. PROPERTIES: This compound features a 4-(2-aminopyrimidin-5-yl)benzoic acid structure, combining an aminopyrimidine group and a benzoic acid moiety. It typically appears as a white to off-white crystalline solid with a molecular weight of approximately 220.2 g/mol (C12H9N3O2). The melting point ranges between 190-195 C, and it exhibits moderate solubility in common organic solvents like ethanol, methanol, and DMSO while being sparingly soluble in water. Proper storage requires a tightly sealed container in a cool, dry place. Safety considerations include wearing appropriate PPE. It is classified as a skin and eye irritant (GHS07) with the hazard statement H315-H319. APPLICATIONS: 4-(2-Aminopyrimidin-5-yl)benzoic acid serves as a versatile intermediate in pharmaceutical and chemical synthesis. Its 4-(2-aminopyrimidin-5-yl)benzoic acid structure allows for participation in various reactions, including esterification, amide bond formation, and nucleophilic substitution at the pyrimidine ring. In medicinal chemistry, it is used to develop bioactive molecules targeting kinases, proteases, and G protein-coupled receptors. The amino group provides hydrogen-bonding capabilities for improved target binding. This compound also functions as a building block in the synthesis of fluorescent dyes and bioconjugation reagents. Academic studies employ it as a model compound in Medicinal Chemistry journals, focusing on optimizing the 4-(2-aminopyrimidin-5-yl)benzoic acid scaffold for improved biological activity and target engagement.
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