| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | NDR6B5CSP6 |
| EPA CompTox | DTXSID1051858 |
Structure
| InChI Key | XFFILAFLGDUMBF-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C8H8O2 |
| Molecular Weight | 136.05 |
| AlogP | 1.26 |
| Hydrogen Bond Acceptor | 2.0 |
| Number of Rotational Bond | 3.0 |
| Polar Surface Area | 26.3 |
| Heavy Atoms | 10.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 2120-70-9 |
| NORMAN SUSDAT | |
| FDA SRS | NDR6B5CSP6 |
| PubChem | 75033 |
| ChemSpider | 67586.0 |
CONTENTS
