Base information
| Cat. No. | |
| CAS No. | 127653-16-1 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C18H10O2 |
| Molecular Weight | 258.271 |
| Exact Mass | 258.068 |
| XLogP3 | 2.7148 |
| Mr | 77.415 |
| PSA | 34.14 |
| Sequence | - |
| Atom number | 30 |
| Bond number | 31 |
| Ring number | 2 |
| Rotor number | 2 |
| Residues number | 0 |
| Canonical smiles | O=Cc1ccc(cc1)C#CC#Cc1ccc(cc1)C=O |
