Base information
| Cat. No. | |
| CAS No. | 139693-52-0 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C18H16BF2NO8 |
| Molecular Weight | 423.129 |
| Exact Mass | 423.094 |
| XLogP3 | 1.5905 |
| Mr | 98.604 |
| PSA | 131.96 |
| Sequence | - |
| Atom number | 46 |
| Bond number | 49 |
| Ring number | 4 |
| Rotor number | 6 |
| Residues number | 0 |
| Canonical smiles | COc1c2N(C=C3C(=[O][B+3]([O-]C3=O)([O-]C(=O)C)[O-]C(=O)C)c2cc(c1F)F)C1CC1 |
