| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | 4UE4F66S87 |
| EPA CompTox | DTXSID70189699 |
Structure
| InChI Key | QZYCWJVSPFQUQC-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C10H6O3 |
| Molecular Weight | 174.03 |
| AlogP | 1.15 |
| Hydrogen Bond Acceptor | 3.0 |
| Number of Rotational Bond | 1.0 |
| Polar Surface Area | 43.37 |
| Heavy Atoms | 13.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 36122-35-7 |
| NORMAN SUSDAT | |
| FDA SRS | 4UE4F66S87 |
| PubChem | 99174 |
| ChemSpider | 89596.0 |
CONTENTS
