Base information
| Cat. No. | |
| CAS No. | 100-26-5 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C7H5NO4 |
| Molecular Weight | 167.119 |
| Exact Mass | 167.022 |
| XLogP3 | 0.478 |
| Mr | 38.1556 |
| PSA | 87.49 |
| Sequence | - |
| Atom number | 17 |
| Bond number | 17 |
| Ring number | 1 |
| Rotor number | 2 |
| Residues number | 0 |
| Canonical smiles | OC(=O)c1ccc(cn1)C(=O)O |
