2-amino-4-oxo-1,4-dihydropyrimidine-5-carbonitrile
$275.00
CAS No.: 27058-50-0
Catalog No.: 192967
Purity: 95%
MF: C5H4N4O
MW: 136.114
Storage: 2-8 degree Celsius
SMILES: NC=1NC=C(C(N1)=O)C#N
Catalog No.: 192967
Purity: 95%
MF: C5H4N4O
MW: 136.114
Storage: 2-8 degree Celsius
SMILES: NC=1NC=C(C(N1)=O)C#N
2-amino-4-oxo-1,4-dihydropyrimidine-5-carbonitrile; CAS No.: 27058-50-0; 2-amino-4-oxo-1,4-dihydropyrimidine-5-carbonitrile. PROPERTIES: This compound appears as a white to off-white crystalline solid with molecular formula C5H4N3O and a molecular weight of 130.10 g/mol. It exhibits a melting point in the range of 230-234 C and demonstrates moderate solubility in polar solvents such as dimethylformamide and dimethyl sulfoxide. The substance is hygroscopic and should be stored in dry conditions. Recommended storage involves maintaining in tightly sealed containers at room temperature with protection from moisture and light. When handling, standard laboratory safety precautions should be observed, including the use of gloves and eye protection, as 2-amino-4-oxo-1,4-dihydropyrimidine-5-carbonitrile may release irritating vapors upon heating. The amino group requires careful handling in strongly acidic environments. APPLICATIONS: In the pharmaceutical industry, 2-amino-4-oxo-1,4-dihydropyrimidine-5-carbonitrile serves as an intermediate for synthesizing non-steroidal anti-inflammatory drugs (NSAIDs), as described in medicinal chemistry literature focusing on pyrimidine derivatives. Its amino substituent enables formation of bioactive amides through amidation reactions. Additionally, this compound functions as a building block for preparing agrochemicals with fungicidal activities through coupling reactions. Academic research has explored its potential in metal coordination chemistry for creating luminescent sensors, as reported in inorganic chemistry journals. The pyrimidinone ring system also facilitates formation of metal-organic frameworks (MOFs), making it valuable for gas storage applications in materials science, as evidenced by studies in crystallography publications.
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