HuagongsheHuagongshe Chemistry Print Report · For research reference only
6-Benzofuraldehyde, 4,7-dihydroxy-2,3-dimethyl-
4,7-Dihydroxy-2,3-dimethyl-6-benzofurancarbaldehyde · 6-Benzofurancarboxaldehyde, 4,7-dihydroxy-2,3-dimethyl-

Identifiers & Physical Properties
| CAS No. | 19665-71-5 |
|---|---|
| Molecular formula | C11H10O4 |
| Average molar mass | 206.19 g/mol |
| Monoisotopic mass | 206.0579088 g/mol |
| SMILES | Cc1oc2c(O)c(C=O)cc(O)c2c1C |
| InChIKey | VTVZMEODWOEJPE-UHFFFAOYSA-N |
| PubChem CID | 29731 |
| DTXSID | DTXSID30173332 |
Chemical & Physical Properties
| XLogP | 2.4 |
|---|---|
| Topological polar surface area | 70.7 |
| Hydrogen bond donors | 2 |
| Hydrogen bond acceptors | 4 |
| Rotatable bonds | 1 |
| Heavy atoms | 15 |
| Formal charge | 0 |
| Complexity | 255 |
| Melting point | 180 °C |
| Boiling point | 214.9±35.0 °C(Predicted) |
| Density | 1.398±0.06 g/cm3(Predicted) |
| pKa (acidity coefficient) | 8.79±0.50(Predicted) |