| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| InChI Key | FBWPWWWZWKPJFL-MRVPVSSYSA-N |
|---|---|
| Smiles | |
| InChI |
|
| Property Name | Value |
|---|---|
| Molecular Formula | C9H12O4 |
| Molecular Weight | 184.07 |
| AlogP | 0.43 |
| Hydrogen Bond Acceptor | 4.0 |
| Hydrogen Bond Donor | 3.0 |
| Number of Rotational Bond | 3.0 |
| Polar Surface Area | 69.92 |
| Heavy Atoms | 13.0 |
| Resources | Reference |
|---|---|
| CAS NUMBER | 67423-45-4 |
| NORMAN SUSDAT |