Base information
| Cat. No. | |
| CAS No. | 6097-08-1 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C14H13NO2 |
| Molecular Weight | 227.259 |
| Exact Mass | 227.095 |
| XLogP3 | 2.024 |
| Mr | 68.918 |
| PSA | 37.38 |
| Sequence | - |
| Atom number | 30 |
| Bond number | 31 |
| Ring number | 2 |
| Rotor number | 4 |
| Residues number | 0 |
| Canonical smiles | C#CCCCCN1C(=O)c2c(C1=O)cccc2 |
