| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | QR6QTL89KS |
| EPA CompTox | DTXSID8038809 |
Structure
| InChI Key | IKZOMJGRWIOEDP-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C4H7Cl1O2 |
| Molecular Weight | 122.01 |
| AlogP | 0.6 |
| Hydrogen Bond Acceptor | 2.0 |
| Number of Rotational Bond | 1.0 |
| Polar Surface Area | 18.46 |
| Heavy Atoms | 7.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 2568-30-1 |
| NORMAN SUSDAT | |
| FDA SRS | QR6QTL89KS |
| PubChem | 75727 |
| ChemSpider | 68244.0 |
CONTENTS
