Base information
| Cat. No. | |
| CAS No. | 2007916-55-2 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C8H13NO2 |
| Molecular Weight | 155.194 |
| Exact Mass | 155.095 |
| XLogP3 | 1.29918 |
| Mr | 40.413 |
| PSA | 42.25 |
| Sequence | - |
| Atom number | 24 |
| Bond number | 24 |
| Ring number | 1 |
| Rotor number | 3 |
| Residues number | 0 |
| Canonical smiles | COC1(OC)CC(C1)CC#N |
