Base information
| Cat. No. | |
| CAS No. | 8031-28-5 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C7H6NNaO3 |
| Molecular Weight | 175.117 |
| Exact Mass | 175.025 |
| XLogP3 | -0.0809 |
| Mr | 37.8864 |
| PSA | 86.38 |
| Sequence | - |
| Atom number | 18 |
| Bond number | 17 |
| Ring number | 1 |
| Rotor number | 1 |
| Residues number | 0 |
| Canonical smiles | Nc1ccc(c(c1)O)C(=O)[O-].[Na+] |
