| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | 8BK92QRM9Q |
| EPA CompTox | DTXSID30182545 |
| InChI Key | SUFHOFZQYXKUCA-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
| Property Name | Value |
|---|---|
| Molecular Formula | C12H14O5 |
| Molecular Weight | 238.08 |
| AlogP | 1.83 |
| Hydrogen Bond Acceptor | 5.0 |
| Number of Rotational Bond | 4.0 |
| Polar Surface Area | 61.83 |
| Heavy Atoms | 17.0 |
| Resources | Reference |
|---|---|
| CAS NUMBER | 28294-47-5 |
| NORMAN SUSDAT | |
| FDA SRS | 8BK92QRM9Q |
| PubChem | 3015410 |
| ChemSpider | 2283558.0 |