4-hydroxy-1H-imidazole-5-carbonitrile
4-hydroxy-1H-imidazole-5-carbonitrile
Also Known As: 4-hydroxy-1H-imidazole-5-carbonitrile|5-hydroxy-1H-imidazole-4-carbonitrile|1H-Imidazole-4-carbonitrile, 5-hydroxy-|5-hydroxy-3H-imidazole-4-carbonitrile
CAS: 79713-03-4
| Molecular Formula | C4H3N3O |
|---|---|
| Molecular Weight | 109.02761 g/mol |
| LogP | 0.6 |
| Topological Polar Surface Area | 72.7 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 109.02761 |
| Monoisotopic Mass | 109.02761 |
| Heavy Atoms | 8 |
| Complexity | 126.0 |
Chemical Identifiers
| CAS Number | 79713-03-4 |
|---|---|
| SMILES | C1=NC(=C(N1)C#N)O |
| InChIKey | WMJORRSQKXCYDF-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Heterocyclic Building Blocks (5 patents)
Pharmaceutical Intermediates (4 patents)
Product Overview
4-hydroxy-1H-imidazole-5-carbonitrile (CAS 79713-03-4), with molecular formula C4H3N3O and molecular weight 109.02761 g/mol. IUPAC: 4-hydroxy-1H-imidazole-5-carbonitrile.
Safety Data Sheet (MSDS / SDS)
View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
View MSDS →
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