Base information
| Cat. No. | |
| CAS No. | 1321-14-8 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C7H7KO5S |
| Molecular Weight | 242.291 |
| Exact Mass | 241.965 |
| XLogP3 | 1.3857 |
| Mr | 42.9644 |
| PSA | 95.04 |
| Sequence | - |
| Atom number | 21 |
| Bond number | 20 |
| Ring number | 1 |
| Rotor number | 2 |
| Residues number | 0 |
| Canonical smiles | COc1cc(ccc1O)S(=O)(=O)[O-].[K+] |
