HuagongsheHuagongshe Chemistry Print Report · For research reference only
3-Chloro-1H-indazol-6-OL
3-Chloro-1H-indazol-6-ol · 1H-Indazol-6-ol, 3-chloro- · 3-Chloro-6-hydroxy (1H)indazole

Identifiers & Physical Properties
| CAS No. | 116570-49-1 |
|---|---|
| Molecular formula | C7H5ClN2O |
| Average molar mass | 168.58 g/mol |
| SMILES | Oc1ccc2c(Cl)[nH]nc2c1 |
| InChIKey | JXVOJLPFEDCFKV-UHFFFAOYSA-N |
| PubChem CID | 135742445 |
| DTXSID | DTXSID20646681 |
Chemical & Physical Properties
| XLogP | 2.2 |
|---|---|
| Topological polar surface area | 48.9 |
| Hydrogen bond donors | 2 |
| Hydrogen bond acceptors | 2 |
| Rotatable bonds | 0 |
| Heavy atoms | 11 |
| Formal charge | 0 |
| Complexity | 155 |
| Melting point | 210 °C |
| Boiling point | 399.1±22.0 °C(Predicted) |
| Density | 1.598±0.06 g/cm3(Predicted) |
| Storage conditions | 2-8°C |
| pKa (acidity coefficient) | 8.73±0.40(Predicted) |