Base information
| Cat. No. | |
| CAS No. | 121-46-0 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C7H8 |
| Molecular Weight | 92.1384 |
| Exact Mass | 92.0626 |
| XLogP3 | 1.7485 |
| Mr | 30.587 |
| PSA | 0 |
| Sequence | - |
| Atom number | 15 |
| Bond number | 16 |
| Ring number | 2 |
| Rotor number | 0 |
| Residues number | 0 |
| Canonical smiles | C1=CC2CC1C=C2 |
