Base information
| Cat. No. | |
| CAS No. | 38339-06-9 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C9H10O7S |
| Molecular Weight | 262.237 |
| Exact Mass | 262.015 |
| XLogP3 | 1.5847 |
| Mr | 56.6996 |
| PSA | 118.51 |
| Sequence | - |
| Atom number | 27 |
| Bond number | 27 |
| Ring number | 1 |
| Rotor number | 5 |
| Residues number | 0 |
| Canonical smiles | COc1cc(ccc1OS(=O)(=O)O)CC(=O)O |
