| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | ZF3IS6G3R7 |
| EPA CompTox | DTXSID2049684 |
Structure
| InChI Key | GUMOJENFFHZAFP-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C12H12O1 |
| Molecular Weight | 172.09 |
| AlogP | 3.24 |
| Hydrogen Bond Acceptor | 1.0 |
| Number of Rotational Bond | 2.0 |
| Polar Surface Area | 9.23 |
| Heavy Atoms | 13.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 93-18-5 |
| NORMAN SUSDAT | |
| FDA SRS | ZF3IS6G3R7 |
| PubChem | 7129 |
| ChemSpider | 6862.0 |
CONTENTS
