Base information
| Cat. No. | |
| CAS No. | 140939-15-7 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C14H20NNaO5S |
| Molecular Weight | 337.367 |
| Exact Mass | 337.096 |
| XLogP3 | 2.3743 |
| Mr | 79.7784 |
| PSA | 95.12 |
| Sequence | - |
| Atom number | 42 |
| Bond number | 41 |
| Ring number | 1 |
| Rotor number | 8 |
| Residues number | 0 |
| Canonical smiles | CCc1cccc(c1N(C(=O)CS(=O)(=O)[O-])COC)CC.[Na+] |
