Base information
| Cat. No. | |
| CAS No. | 83417-93-0 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C40H36O2Ti |
| Molecular Weight | 596.58 |
| Exact Mass | 596.219 |
| XLogP3 | 10.5522 |
| Mr | 172.874 |
| PSA | 18.46 |
| Sequence | - |
| Atom number | 79 |
| Bond number | 86 |
| Ring number | 9 |
| Rotor number | 3 |
| Residues number | 0 |
| Canonical smiles | [Ti]1Oc2ccc3c(c2-c2c(O1)ccc1c2cccc1)cccc3.C1CC[C]2[C](C1)[C](CC[C]1[CH][CH][C]3[C]1CCCC3)[CH][CH]2 |
