3-Butyl-4-methylfuran-2,5-dione
3-butyl-4-methylfuran-2,5-dione
Also Known As: 3-butyl-4-methylfuran-2,5-dione|3-Butyl-4-methyl-2,5-furandion|3-butyl-4-methyl-furan-2,5-dione|J3.327.211A|3-Butyl-4-methyl-2,5-dihydrofuran-2,5-dione
CAS: 7541-33-5
| Molecular Formula | C9H12O3 |
|---|---|
| Molecular Weight | 168.07864 g/mol |
| LogP | 2.1 |
| Topological Polar Surface Area | 43.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 168.07864 |
| Monoisotopic Mass | 168.07864 |
| Heavy Atoms | 12 |
| Complexity | 250.0 |
Chemical Identifiers
| CAS Number | 7541-33-5 |
|---|---|
| SMILES | CCCCC1=C(C(=O)OC1=O)C |
| InChIKey | DSBDZNXGSRQPPT-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Agrochemicals (2 patents)
Heterocyclic Building Blocks (6 patents)
Pharmaceutical Intermediates (1 patents)
Polymer Intermediates (1 patents)
Product Overview
3-Butyl-4-methylfuran-2,5-dione (CAS 7541-33-5), with molecular formula C9H12O3 and molecular weight 168.07864 g/mol. IUPAC: 3-butyl-4-methylfuran-2,5-dione.
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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