| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | J9P2G65CXJ |
| EPA CompTox | DTXSID6065846 |
| InChI Key | JKJWYKGYGWOAHT-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
| Property Name | Value |
|---|---|
| Molecular Formula | C7H10O3 |
| Molecular Weight | 142.06 |
| AlogP | 1.51 |
| Hydrogen Bond Acceptor | 3.0 |
| Number of Rotational Bond | 4.0 |
| Polar Surface Area | 35.53 |
| Heavy Atoms | 10.0 |
| Resources | Reference |
|---|---|
| CAS NUMBER | 15022-08-9 |
| NORMAN SUSDAT | |
| FDA SRS | J9P2G65CXJ |
| PubChem | 84764 |
| ChemSpider | 76468.0 |