| Keyword(s): | Human Neurotoxin |
| Molecule Category | Free-form |
| UNII | 540OPI9I4Z |
| EPA CompTox | DTXSID00897230 |
Structure
| InChI Key | XXLWNLKEOWWHDC-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C10H14Cl1N1 |
| Molecular Weight | 183.08 |
| AlogP | 2.49 |
| Hydrogen Bond Acceptor | 1.0 |
| Hydrogen Bond Donor | 1.0 |
| Number of Rotational Bond | 3.0 |
| Polar Surface Area | 12.03 |
| Heavy Atoms | 12.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 1199-85-5 |
| NORMAN SUSDAT | |
| FDA SRS | 540OPI9I4Z |
| PubChem | 3128 |
| ChemSpider | 3016.0 |
CONTENTS
