HuagongsheHuagongshe Chemistry Print Report · For research reference only
2,3-Dimethyl-5-nitrobenzoic acid
Identifiers & Physical Properties
| Molecular formula | C9H9NO4 |
|---|---|
| Average molar mass | 195.17 g/mol |
| SMILES | Cc1cc([N+](=O)[O-])cc(C(=O)O)c1C |
| InChIKey | LAUMVOSQJSQRJG-UHFFFAOYSA-N |
| PubChem CID | 13758131 |
Chemical & Physical Properties
| XLogP | 2 |
|---|---|
| Topological polar surface area | 83.1 |
| Hydrogen bond donors | 1 |
| Hydrogen bond acceptors | 4 |
| Rotatable bonds | 1 |
| Heavy atoms | 14 |
| Formal charge | 0 |
| Complexity | 248 |