Base information
| Cat. No. | |
| CAS No. | 11067-82-6 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C18H21NaO3S |
| Molecular Weight | 340.412 |
| Exact Mass | 340.111 |
| XLogP3 | 4.0722 |
| Mr | 84.2384 |
| PSA | 65.58 |
| Sequence | - |
| Atom number | 44 |
| Bond number | 47 |
| Ring number | 5 |
| Rotor number | 1 |
| Residues number | 0 |
| Canonical smiles | CC1Cc2c1c1CC(C34c(c2C3(C)C(C4)C)c1S(=O)(=O)[O-])C.[Na+] |
