Base information
| Cat. No. | |
| CAS No. | 1329613-50-4 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C6H5NaO6S |
| Molecular Weight | 228.155 |
| Exact Mass | 227.97 |
| XLogP3 | 1.1497 |
| Mr | 38.8309 |
| PSA | 105.02 |
| Sequence | - |
| Atom number | 19 |
| Bond number | 18 |
| Ring number | 1 |
| Rotor number | 4 |
| Residues number | 0 |
| Canonical smiles | O=Cc1ccc(o1)COS(=O)(=O)[O-].[Na+] |
