| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | 7ZY3UK34C4 |
| EPA CompTox | DTXSID6062179 |
Structure
| InChI Key | UCTUXUGXIFRVGX-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C10H12O4 |
| Molecular Weight | 196.07 |
| AlogP | 1.52 |
| Hydrogen Bond Acceptor | 4.0 |
| Number of Rotational Bond | 4.0 |
| Polar Surface Area | 44.76 |
| Heavy Atoms | 14.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 2103-57-3 |
| NORMAN SUSDAT | |
| FDA SRS | 7ZY3UK34C4 |
| PubChem | 75006 |
| ChemSpider | 67561.0 |
CONTENTS
