| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | M65DE5KU8F |
| EPA CompTox | DTXSID0059409 |
Structure
| InChI Key | CJKRXEBLWJVYJD-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C6H16N2 |
| Molecular Weight | 116.13 |
| AlogP | 0.21 |
| Hydrogen Bond Acceptor | 2.0 |
| Hydrogen Bond Donor | 2.0 |
| Number of Rotational Bond | 5.0 |
| Polar Surface Area | 24.06 |
| Heavy Atoms | 8.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 111-74-0 |
| NORMAN SUSDAT | |
| FDA SRS | M65DE5KU8F |
| PubChem | 67105 |
| ChemSpider | 60453.0 |
CONTENTS
