Base information
| Cat. No. | |
| CAS No. | 82611-85-6 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C11H16NNaO3S |
| Molecular Weight | 265.304 |
| Exact Mass | 265.075 |
| XLogP3 | 2.529 |
| Mr | 63.7544 |
| PSA | 68.82 |
| Sequence | - |
| Atom number | 33 |
| Bond number | 32 |
| Ring number | 1 |
| Rotor number | 6 |
| Residues number | 0 |
| Canonical smiles | CCN(c1ccccc1)CCCS(=O)(=O)[O-].[Na+] |
