Base information
| Cat. No. | |
| CAS No. | 121461-69-6 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C14H15BF2N2Na2O6S2 |
| Molecular Weight | 466.196 |
| Exact Mass | 466.023 |
| XLogP3 | 3.4029 |
| Mr | 97.7798 |
| PSA | 147.77 |
| Sequence | - |
| Atom number | 44 |
| Bond number | 44 |
| Ring number | 3 |
| Rotor number | 2 |
| Residues number | 0 |
| Canonical smiles | CC1=[N+]2C(=C(C)c3n([B-]2(F)F)c(C)c(c3C)S(=O)(=O)[O-])C(=C1S(=O)(=O)[O-])C.[Na+].[Na+] |
