Base information
| Cat. No. | |
| CAS No. | 1300-61-4 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C7H9NaO7S |
| Molecular Weight | 260.197 |
| Exact Mass | 259.997 |
| XLogP3 | 1.4661 |
| Mr | 49.4429 |
| PSA | 129.51 |
| Sequence | - |
| Atom number | 25 |
| Bond number | 23 |
| Ring number | 1 |
| Rotor number | 2 |
| Residues number | 0 |
| Canonical smiles | OC(=O)c1cc(ccc1O)S(=O)(=O)O.[NaH].O |
