3-Butyl-1-oxidopyridin-1-ium
3-butyl-1-oxidopyridin-1-ium
Also Known As: 3-Butylpyridine 1-oxide|3-Butylpyridine1-oxide|3-butyl-1-oxidopyridin-1-ium|3-butylpyridin-1-ium-1-olate|Pyridine, 3-butyl-, 1-oxide
CAS: 31396-33-5
| Molecular Formula | C9H13NO |
|---|---|
| Molecular Weight | 151.09972 g/mol |
| LogP | 1.7 |
| Topological Polar Surface Area | 25.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Exact Mass | 151.09972 |
| Monoisotopic Mass | 151.09972 |
| Heavy Atoms | 11 |
| Complexity | 106.0 |
Chemical Identifiers
| CAS Number | 31396-33-5 |
|---|---|
| SMILES | CCCCC1=C[N+](=CC=C1)[O-] |
| InChIKey | FFEBYOQFJJDYED-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Heterocyclic Building Blocks (4 patents)
Product Overview
3-Butyl-1-oxidopyridin-1-ium (CAS 31396-33-5), with molecular formula C9H13NO and molecular weight 151.09972 g/mol. IUPAC: 3-butyl-1-oxidopyridin-1-ium.
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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