| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | UAT3SX9MTD |
| EPA CompTox | DTXSID40190959 |
| InChI Key | UTBCRHAMJFMIIR-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
| Property Name | Value |
|---|---|
| Molecular Formula | C4H5Cl1O3 |
| Molecular Weight | 135.99 |
| AlogP | 0.31 |
| Hydrogen Bond Acceptor | 3.0 |
| Number of Rotational Bond | 2.0 |
| Polar Surface Area | 43.37 |
| Heavy Atoms | 8.0 |
| Resources | Reference |
|---|---|
| CAS NUMBER | 37517-81-0 |
| NORMAN SUSDAT | |
| FDA SRS | UAT3SX9MTD |
| PubChem | 123460 |
| ChemSpider | 110056.0 |