CAS 216959-98-7: 4-(2-Amino-4-pyrimidinyl)benzoic acid

Description: 4-(2-Amino-4-pyrimidinyl)benzoic acid, also known by its CAS number 216959-98-7, is an organic compound characterized by its structure, which features a benzoic acid moiety substituted with a pyrimidine ring. This compound typically exhibits properties such as being a solid at room temperature, with potential solubility in polar solvents due to the presence of both amino and carboxylic acid functional groups. The amino group can participate in hydrogen bonding, enhancing its reactivity and solubility in aqueous environments. Its pyrimidine ring contributes to its aromatic character and may influence its biological activity, making it of interest in pharmaceutical research. The compound may also exhibit acidic properties due to the carboxylic acid group, allowing it to act as a weak acid in solution. Overall, 4-(2-Amino-4-pyrimidinyl)benzoic acid is a compound of interest in medicinal chemistry, potentially serving as a building block for drug development or as a research tool in biochemical studies.

Formula: C₁₁H₉N₃O₂

InChI: InChI=1S/C11H9N3O2/c12-11-13-6-5-9(14-11)7-1-3-8(4-2-7)10(15)16/h1-6H,(H,15,16)(H2,12,13,14)

InChI key: InChIKey=STTNRXJTCMXMSX-UHFFFAOYSA-N

SMILES: O=C(O)C=1C=CC(=CC1)C2=NC(=NC=C2)N

Synonyms:

• Benzoic acid, 4-(2-amino-4-pyrimidinyl)-
• 4-(2-Amino-4-pyrimidinyl)benzoic acid
• 4-(2-Aminopyrimidin-4-yl)benzoic acid

4-(2-Aminopyrimidin-4-yl)benzoic acid

CAS: 216959-98-7

• Purity: 97.0%
• Molecular weight: 215.21200561523438

4-(2-Aminopyrimidin-4-yl)benzoic acid

CAS: 216959-98-7

• Formula: C₁₁H₉N₃O₂
• Purity: 95% (Typical Value in Batch COA)
• Color and Shape: white to off-white powder
• Molecular weight: 215.21g/mol

4-(2-Aminopyrimidin-4-yl)benzoic Acid

CAS: 216959-98-7

• Formula: C₁₁H₉N₃O₂
• Color and Shape: Neat
• Molecular weight: 215.208

4-(2-Aminopyrimidin-4-yl)benzoic acid

CAS: 216959-98-7

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• Formula: C₁₁H₉N₃O₂
• Purity: Min. 95%
• Molecular weight: 215.21 g/mol