| Keyword(s): | Human Neurotoxin |
| Molecule Category | Free-form |
| UNII | ADV1WUE1NB |
| EPA CompTox | DTXSID0021545 |
Structure
| InChI Key | GAWAYYRQGQZKCR-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C3H5Cl1O2 |
| Molecular Weight | 108.0 |
| AlogP | 0.7 |
| Hydrogen Bond Acceptor | 1.0 |
| Hydrogen Bond Donor | 1.0 |
| Number of Rotational Bond | 1.0 |
| Polar Surface Area | 37.3 |
| Heavy Atoms | 6.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 598-78-7 |
| NORMAN SUSDAT | |
| FDA SRS | ADV1WUE1NB |
| PubChem | 11734 |
| ChemSpider | 11241.0 |
CONTENTS
