| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| EPA CompTox | DTXSID9021504 |
Structure
| InChI Key | HGDYZULTRRRRFK-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C2H2Br1Cl1O1 |
| Molecular Weight | 155.9 |
| AlogP | 1.15 |
| Hydrogen Bond Acceptor | 1.0 |
| Number of Rotational Bond | 1.0 |
| Polar Surface Area | 17.07 |
| Heavy Atoms | 5.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 98136-99-3 |
| NORMAN SUSDAT | |
| PubChem | 542763 |
| ChemSpider | 472648.0 |
CONTENTS
