Base information
| Cat. No. | |
| CAS No. | 69659-80-9 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C19H19NaO6S |
| Molecular Weight | 398.405 |
| Exact Mass | 398.08 |
| XLogP3 | 4.6879 |
| Mr | 95.6708 |
| PSA | 110.03 |
| Sequence | - |
| Atom number | 46 |
| Bond number | 48 |
| Ring number | 4 |
| Rotor number | 1 |
| Residues number | 0 |
| Canonical smiles | O=C1c2c(-c3c(C1=O)c(C)c(o3)S(=O)(=O)O)ccc1c2CCCC1(C)C.[NaH] |
