HuagongsheHuagongshe Chemistry Print Report · For research reference only
Methyl 6-hydroxy-1,3-benzodioxole-5-carboxylate
Identifiers & Physical Properties
| Molecular formula | C9H8O5 |
|---|---|
| Average molar mass | 196.16 g/mol |
| SMILES | COC(=O)c1cc2c(cc1O)OCO2 |
| InChIKey | PEUVAECVOVWYJV-UHFFFAOYSA-N |
| PubChem CID | 590804 |
Chemical & Physical Properties
| XLogP | 1.8 |
|---|---|
| Topological polar surface area | 65 |
| Hydrogen bond donors | 1 |
| Hydrogen bond acceptors | 5 |
| Rotatable bonds | 2 |
| Heavy atoms | 14 |
| Formal charge | 0 |
| Complexity | 229 |