| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | BWU4IG3WAC |
| EPA CompTox | DTXSID80871078 |
Structure
| InChI Key | YAXKTBLXMTYWDQ-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C4H10O3 |
| Molecular Weight | 106.06 |
| AlogP | -1.28 |
| Hydrogen Bond Acceptor | 3.0 |
| Hydrogen Bond Donor | 3.0 |
| Number of Rotational Bond | 2.0 |
| Polar Surface Area | 60.69 |
| Heavy Atoms | 7.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 4435-50-1 |
| NORMAN SUSDAT | |
| FDA SRS | BWU4IG3WAC |
| PubChem | 20497 |
CONTENTS
