Base information
| Cat. No. | |
| CAS No. | 6870-33-3 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C8H13NO3 |
| Molecular Weight | 171.194 |
| Exact Mass | 171.09 |
| XLogP3 | -0.6747 |
| Mr | 48.3696 |
| PSA | 69.89 |
| Sequence | - |
| Atom number | 25 |
| Bond number | 26 |
| Ring number | 2 |
| Rotor number | 1 |
| Residues number | 0 |
| Canonical smiles | OCC1=CC[N@@+]2([C@H]1[C@H](O)CC2)[O-] |
