Base information
| Cat. No. | |
| CAS No. | 23795-03-1 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C13H18NNaO4S |
| Molecular Weight | 307.341 |
| Exact Mass | 307.085 |
| XLogP3 | 1.9416 |
| Mr | 71.484 |
| PSA | 85.89 |
| Sequence | - |
| Atom number | 38 |
| Bond number | 37 |
| Ring number | 1 |
| Rotor number | 7 |
| Residues number | 0 |
| Canonical smiles | CCCN(S(=O)(=O)c1ccc(cc1)C(=O)[O-])CCC.[Na+] |
