Base information
| Cat. No. | |
| CAS No. | 82611-88-9 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C12H20NNaO4S |
| Molecular Weight | 297.346 |
| Exact Mass | 297.101 |
| XLogP3 | 2.9927 |
| Mr | 73.2098 |
| PSA | 75.22 |
| Sequence | - |
| Atom number | 39 |
| Bond number | 38 |
| Ring number | 1 |
| Rotor number | 7 |
| Residues number | 0 |
| Canonical smiles | CCN(c1cccc(c1)OC)CCCS(=O)(=O)O.[NaH] |
