1-Hydroxypyrrole-2-carbonitrile
1-hydroxypyrrole-2-carbonitrile
Also Known As: 1-hydroxypyrrole-2-carbonitrile|2-cyano-N-hydroxypyrrole|1H-Pyrrole-2-carbonitrile, 1-hydroxy-|1-hydroxy-1H-pyrrole-2-carbonitrile
CAS: 40090-74-2
| Molecular Formula | C5H4N2O |
|---|---|
| Molecular Weight | 108.032364 g/mol |
| LogP | 1.3 |
| Topological Polar Surface Area | 49.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 108.032364 |
| Monoisotopic Mass | 108.032364 |
| Heavy Atoms | 8 |
| Complexity | 126.0 |
Chemical Identifiers
| CAS Number | 40090-74-2 |
|---|---|
| SMILES | C1=CN(C(=C1)C#N)O |
| InChIKey | ZKLOEAZWAQWECG-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Heterocyclic Building Blocks (3 patents)
Product Overview
1-Hydroxypyrrole-2-carbonitrile (CAS 40090-74-2), with molecular formula C5H4N2O and molecular weight 108.032364 g/mol. IUPAC: 1-hydroxypyrrole-2-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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