| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | 0IE1619UGN |
| EPA CompTox | DTXSID8061474 |
| InChI Key | LNZBSIXPXJKKDF-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
| Property Name | Value |
|---|---|
| Molecular Formula | C9H8O3 |
| Molecular Weight | 164.05 |
| AlogP | 1.08 |
| Hydrogen Bond Acceptor | 3.0 |
| Number of Rotational Bond | 3.0 |
| Polar Surface Area | 43.37 |
| Heavy Atoms | 12.0 |
| Resources | Reference |
|---|---|
| CAS NUMBER | 1076-95-5 |
| NORMAN SUSDAT | |
| FDA SRS | 0IE1619UGN |
| PubChem | 70643 |
| ChemSpider | 63809.0 |