Base information
| Cat. No. | |
| CAS No. | 100-52-7 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C7H6O |
| Molecular Weight | 106.122 |
| Exact Mass | 106.042 |
| XLogP3 | 1.4991 |
| Mr | 31.8295 |
| PSA | 17.07 |
| Sequence | - |
| Atom number | 14 |
| Bond number | 14 |
| Ring number | 1 |
| Rotor number | 1 |
| Residues number | 0 |
| Canonical smiles | O=Cc1ccccc1 |
