HuagongsheHuagongshe Chemistry Print Report · For research reference only
5H-1,3-Dioxolo[4,5-f]isoindole-5,7(6H)-dione
![5H-1,3-Dioxolo[4,5-f]isoindole-5,7(6H)-dione molecular structure](/img/chemical/322366.png)
Identifiers & Physical Properties
| CAS No. | 4846-32-6 |
|---|---|
| Molecular formula | C9H5NO4 |
| Average molar mass | 191.14 g/mol |
| Monoisotopic mass | 191.02185764 g/mol |
| SMILES | O=C1NC(=O)c2cc3c(cc21)OCO3 |
| InChIKey | WXYGGWKJYRLNCL-UHFFFAOYSA-N |
| PubChem CID | 322366 |
| DTXSID | DTXSID50313995 |
Chemical & Physical Properties
| XLogP | 0.5 |
|---|---|
| Topological polar surface area | 64.6 |
| Hydrogen bond donors | 1 |
| Hydrogen bond acceptors | 4 |
| Rotatable bonds | 0 |
| Heavy atoms | 14 |
| Formal charge | 0 |
| Complexity | 275 |