| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | U5USE33Y47 |
| EPA CompTox | DTXSID10184921 |
Structure
| InChI Key | NYPNCQTUZYWFGG-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C4H10O3 |
| Molecular Weight | 106.06 |
| AlogP | -0.4 |
| Hydrogen Bond Acceptor | 3.0 |
| Hydrogen Bond Donor | 1.0 |
| Number of Rotational Bond | 3.0 |
| Polar Surface Area | 38.69 |
| Heavy Atoms | 7.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 30934-97-5 |
| NORMAN SUSDAT | |
| FDA SRS | U5USE33Y47 |
| PubChem | 542381 |
| ChemSpider | 472323.0 |
CONTENTS
