| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | F2KZY84Y8G |
| EPA CompTox | DTXSID3059927 |
Structure
| InChI Key | IELVMUPSWDZWSD-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C5H6F6O2 |
| Molecular Weight | 212.03 |
| AlogP | 0.88 |
| Hydrogen Bond Acceptor | 2.0 |
| Hydrogen Bond Donor | 2.0 |
| Number of Rotational Bond | 4.0 |
| Polar Surface Area | 40.46 |
| Heavy Atoms | 13.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 376-90-9 |
| NORMAN SUSDAT | |
| FDA SRS | F2KZY84Y8G |
| PubChem | 67831 |
| ChemSpider | 61148.0 |
CONTENTS
