| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | R33083ZT00 |
| EPA CompTox | DTXSID1064370 |
| InChI Key | BMURONZFJJPAOK-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
| Property Name | Value |
|---|---|
| Molecular Formula | C12H9Cl1O1 |
| Molecular Weight | 204.03 |
| AlogP | 4.13 |
| Hydrogen Bond Acceptor | 1.0 |
| Number of Rotational Bond | 2.0 |
| Polar Surface Area | 9.23 |
| Heavy Atoms | 14.0 |
| Resources | Reference |
|---|---|
| CAS NUMBER | 6452-49-9 |
| NORMAN SUSDAT | |
| FDA SRS | R33083ZT00 |
| PubChem | 94325 |
| ChemSpider | 21915.0 |