Base information
| Cat. No. | |
| CAS No. | 36639-50-6 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C7H6NNaO5S |
| Molecular Weight | 239.181 |
| Exact Mass | 238.986 |
| XLogP3 | 2.244 |
| Mr | 48.9144 |
| PSA | 111.4 |
| Sequence | - |
| Atom number | 21 |
| Bond number | 20 |
| Ring number | 1 |
| Rotor number | 3 |
| Residues number | 0 |
| Canonical smiles | [O-][N+](=O)c1ccc(cc1)CS(=O)(=O)[O-].[Na+] |
