| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | 2CAF8W2YSZ |
| EPA CompTox | DTXSID10974369 |
Structure
| InChI Key | IXMBFXZUCVOLMS-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C10H22O5 |
| Molecular Weight | 222.15 |
| AlogP | 0.06 |
| Hydrogen Bond Acceptor | 5.0 |
| Hydrogen Bond Donor | 1.0 |
| Number of Rotational Bond | 11.0 |
| Polar Surface Area | 57.15 |
| Heavy Atoms | 15.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 58872-88-1 |
| NORMAN SUSDAT | |
| FDA SRS | 2CAF8W2YSZ |
| PubChem | 100871 |
CONTENTS
