Base information
| Cat. No. | |
| CAS No. | 13633-26-6 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C10H8 |
| Molecular Weight | 128.171 |
| Exact Mass | 128.063 |
| XLogP3 | 2.2241 |
| Mr | 43.517 |
| PSA | 0 |
| Sequence | - |
| Atom number | 18 |
| Bond number | 18 |
| Ring number | 1 |
| Rotor number | 0 |
| Residues number | 0 |
| Canonical smiles | C=CC#Cc1ccccc1 |
