| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | MNM22D66K8 |
| EPA CompTox | DTXSID4062060 |
Structure
| InChI Key | NGCRLFIYVFOUMZ-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C9H3Cl3N2O1 |
| Molecular Weight | 259.93 |
| AlogP | 3.32 |
| Hydrogen Bond Acceptor | 3.0 |
| Number of Rotational Bond | 1.0 |
| Polar Surface Area | 42.85 |
| Heavy Atoms | 15.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 1919-43-3 |
| NORMAN SUSDAT | |
| FDA SRS | MNM22D66K8 |
| PubChem | 74714 |
| ChemSpider | 67287.0 |
CONTENTS
