HuagongsheHuagongshe Chemistry Print Report · For research reference only
1,3-Dibromonaphthalene-2-ol
1,3-Dibromo-2-naphthol · 1,3-dibromonaphthalen-2-ol · 1,3-Dibromonaphthalene-2-ol · 2-Naphthalenol, 1,3-dibromo-
Identifiers & Physical Properties
| CAS No. | 30478-89-8 |
|---|---|
| Molecular formula | C10H6Br2O |
| Average molar mass | 301.96 g/mol |
| Monoisotopic mass | 299.87853901 g/mol |
| SMILES | Oc1c(Br)cc2ccccc2c1Br |
| InChIKey | BPABLEVYTPZMOJ-UHFFFAOYSA-N |
| PubChem CID | 12032453 |
| DTXSID | DTXSID00476206 |
Chemical & Physical Properties
| XLogP | 4.2 |
|---|---|
| Topological polar surface area | 20.2 |
| Hydrogen bond donors | 1 |
| Hydrogen bond acceptors | 1 |
| Rotatable bonds | 0 |
| Heavy atoms | 13 |
| Formal charge | 0 |
| Complexity | 186 |
| SpringerMaterials Properties | 13C nuclear magnetic resonance spectrum |
| Melting point | 75 °C |
| Boiling point | 327.9±22.0 °C(Predicted) |
| Density | 1.956±0.06 g/cm3(Predicted) |
| pKa (acidity coefficient) | 5.71±0.50(Predicted) |