Base information
| Cat. No. | |
| CAS No. | 12113-07-4 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C18H18BNaO |
| Molecular Weight | 284.136 |
| Exact Mass | 284.135 |
| XLogP3 | 4.5659 |
| Mr | 86.2405 |
| PSA | 17.07 |
| Sequence | - |
| Atom number | 39 |
| Bond number | 40 |
| Ring number | 3 |
| Rotor number | 3 |
| Residues number | 0 |
| Canonical smiles | [O-][B+3]([CH-]1=CC=CC=C1)([CH-]1=CC=CC=C1)[CH-]1=CC=CC=C1.[Na+] |
