Base information
| Cat. No. | |
| CAS No. | 168021-79-2 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C11H15NNa2O7S2 |
| Molecular Weight | 383.349 |
| Exact Mass | 383.009 |
| XLogP3 | 2.9618 |
| Mr | 75.9659 |
| PSA | 175.24 |
| Sequence | - |
| Atom number | 38 |
| Bond number | 36 |
| Ring number | 1 |
| Rotor number | 4 |
| Residues number | 0 |
| Canonical smiles | [O-]N(=Cc1ccc(cc1S(=O)(=O)O)S(=O)(=O)[O-])C(C)(C)C.[Na+].[Na+] |
