HuagongsheHuagongshe Chemistry Print Report · For research reference only
3-Pyrazolecarboxylic acid, 4-amino-5-(m-chlorophenyl)-
Identifiers & Physical Properties
| CAS No. | 91948-27-5 |
|---|---|
| Molecular formula | C10H8ClN3O2 |
| Average molar mass | 237.64 g/mol |
| Monoisotopic mass | 237.0305042 g/mol |
| SMILES | Nc1c(-c2cccc(Cl)c2)n[nH]c1C(=O)O |
| InChIKey | OZYHUFTVCMWPEO-UHFFFAOYSA-N |
| PubChem CID | 3045310 |
| DTXSID | DTXSID70238797 |
Chemical & Physical Properties
| XLogP | 2.2 |
|---|---|
| Topological polar surface area | 92 |
| Hydrogen bond donors | 3 |
| Hydrogen bond acceptors | 4 |
| Rotatable bonds | 2 |
| Heavy atoms | 16 |
| Formal charge | 0 |
| Complexity | 277 |