4H-Pyran-4-one, 2-butyl-3-hydroxy-
2-butyl-3-hydroxypyran-4-one
Also Known As: 2-Butyl-3-hydroxy-4H-pyran-4-one|4H-Pyran-4-one, 2-butyl-3-hydroxy-|2-butyl-3-hydroxypyran-4-one
CAS: 4940-17-4
| Molecular Formula | C9H12O3 |
|---|---|
| Molecular Weight | 168.07864 g/mol |
| LogP | 1.688 |
| Topological Polar Surface Area | 50.44 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 168.07864 |
| Monoisotopic Mass | 168.07864 |
| Heavy Atoms | 12 |
| Complexity | 300.88712 |
Chemical Identifiers
| CAS Number | 4940-17-4 |
|---|---|
| SMILES | CCCCC1=C(C(=O)C=CO1)O |
Product Overview
4H-Pyran-4-one, 2-butyl-3-hydroxy- (CAS 4940-17-4), with molecular formula C9H12O3 and molecular weight 168.07864 g/mol. IUPAC: 2-butyl-3-hydroxypyran-4-one.
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.
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