| Keyword(s): | Natural Toxins |
| Molecule Category | Free-form |
| UNII | 422ZU9N5TV |
| EPA CompTox | DTXSID2075340 |
Structure
| InChI Key | APJYDQYYACXCRM-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C10H12N2 |
| Molecular Weight | 160.1 |
| AlogP | 1.67 |
| Hydrogen Bond Acceptor | 1.0 |
| Hydrogen Bond Donor | 2.0 |
| Number of Rotational Bond | 2.0 |
| Polar Surface Area | 41.81 |
| Heavy Atoms | 12.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 61-54-1 |
| NORMAN SUSDAT | |
| FDA SRS | 422ZU9N5TV |
| PubChem | 1150 |
| ChemSpider | 1118.0 |
CONTENTS
