HuagongsheHuagongshe Chemistry Print Report · For research reference only
2,5-Diacetylfuran
2,5-Diacetylfuran · 1-(5-Acetylfuran-2-yl)ethanone · 1,1'-(2,5-Furandiyl)bisethanone
Identifiers & Physical Properties
| CAS No. | 38071-72-6 |
|---|---|
| Molecular formula | C8H8O3 |
| Average molar mass | 152.15 g/mol |
| Monoisotopic mass | 152.04734411 g/mol |
| SMILES | CC(=O)c1ccc(C(C)=O)o1 |
| InChIKey | HJULPPMMCXMWJA-UHFFFAOYSA-N |
| PubChem CID | 5017444 |
| DTXSID | DTXSID10407546 |
Chemical & Physical Properties
| XLogP | 1 |
|---|---|
| Topological polar surface area | 47.3 |
| Hydrogen bond donors | 0 |
| Hydrogen bond acceptors | 3 |
| Rotatable bonds | 2 |
| Heavy atoms | 11 |
| Formal charge | 0 |
| Complexity | 166 |
| Melting point | 94℃ |