| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | TK58UR1S48 |
| EPA CompTox | DTXSID2042486 |
Structure
| InChI Key | WCLDITPGPXSPGV-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C8H5Cl3O3 |
| Molecular Weight | 253.93 |
| AlogP | 3.35 |
| Hydrogen Bond Acceptor | 2.0 |
| Hydrogen Bond Donor | 1.0 |
| Number of Rotational Bond | 2.0 |
| Polar Surface Area | 46.53 |
| Heavy Atoms | 14.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 2307-49-5 |
| NORMAN SUSDAT | |
| FDA SRS | TK58UR1S48 |
| PubChem | 16824 |
| ChemSpider | 15943.0 |
CONTENTS
