| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | ZAP6AZ2WW7 |
| EPA CompTox | DTXSID40964970 |
Structure
| InChI Key | RZRBXGPSHVAUQO-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C10H18O2 |
| Molecular Weight | 170.13 |
| AlogP | 1.88 |
| Hydrogen Bond Acceptor | 2.0 |
| Hydrogen Bond Donor | 1.0 |
| Number of Rotational Bond | 4.0 |
| Polar Surface Area | 32.76 |
| Heavy Atoms | 12.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 50727-94-1 |
| NORMAN SUSDAT | |
| FDA SRS | ZAP6AZ2WW7 |
| PubChem | 530403 |
CONTENTS
