Base information
| Cat. No. | |
| CAS No. | 68213-89-8 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C16H12NNaO4S |
| Molecular Weight | 337.326 |
| Exact Mass | 337.038 |
| XLogP3 | 4.3469 |
| Mr | 83.5221 |
| PSA | 97.84 |
| Sequence | - |
| Atom number | 35 |
| Bond number | 36 |
| Ring number | 3 |
| Rotor number | 3 |
| Residues number | 0 |
| Canonical smiles | Oc1cc(cc2c1ccc(c2)Nc1ccccc1)S(=O)(=O)[O-].[Na+] |
