| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| EPA CompTox | DTXSID7065706 |
Structure
| InChI Key | TZPKFPYZCMHDHL-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C10H14O3 |
| Molecular Weight | 182.09 |
| AlogP | 2.02 |
| Hydrogen Bond Acceptor | 3.0 |
| Number of Rotational Bond | 3.0 |
| Polar Surface Area | 27.69 |
| Heavy Atoms | 13.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 14107-97-2 |
| NORMAN SUSDAT | |
| PubChem | 84201 |
| ChemSpider | 75960.0 |
CONTENTS
