| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | 43A7SQ7ZFR |
| EPA CompTox | DTXSID30965714 |
| InChI Key | LBNWZGLSMCTAQB-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
| Property Name | Value |
|---|---|
| Molecular Formula | C10H14O3 |
| Molecular Weight | 182.09 |
| AlogP | 1.37 |
| Hydrogen Bond Acceptor | 3.0 |
| Hydrogen Bond Donor | 1.0 |
| Polar Surface Area | 46.53 |
| Heavy Atoms | 13.0 |
| Resources | Reference |
|---|---|
| CAS NUMBER | 514-93-2 |
| NORMAN SUSDAT | |
| FDA SRS | 43A7SQ7ZFR |
| PubChem | 156203 |