| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | BLE7M46MUT |
| EPA CompTox | DTXSID1060348 |
| InChI Key | JATAKEDDMQNPOQ-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
| Property Name | Value |
|---|---|
| Molecular Formula | C10H12O5 |
| Molecular Weight | 212.07 |
| AlogP | 1.41 |
| Hydrogen Bond Acceptor | 4.0 |
| Hydrogen Bond Donor | 1.0 |
| Number of Rotational Bond | 4.0 |
| Polar Surface Area | 64.99 |
| Heavy Atoms | 15.0 |
| Resources | Reference |
|---|---|
| CAS NUMBER | 570-02-5 |
| NORMAN SUSDAT | |
| FDA SRS | BLE7M46MUT |
| PubChem | 68441 |
| ChemSpider | 61721.0 |