Base information
| Cat. No. | |
| CAS No. | 179942-55-3 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C7H7BN4O2 |
| Molecular Weight | 189.967 |
| Exact Mass | 190.066 |
| XLogP3 | -1.4535 |
| Mr | 49.4393 |
| PSA | 94.92 |
| Sequence | - |
| Atom number | 21 |
| Bond number | 22 |
| Ring number | 2 |
| Rotor number | 2 |
| Residues number | 0 |
| Canonical smiles | OB(c1ccc(cc1)c1n[nH]nn1)O |
