| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | 4G03VY2NKP |
| EPA CompTox | DTXSID3049336 |
Structure
| InChI Key | PSJBSUHYCGQTHZ-UHFFFAOYNA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C4H10O3 |
| Molecular Weight | 106.06 |
| AlogP | -1.01 |
| Hydrogen Bond Acceptor | 3.0 |
| Hydrogen Bond Donor | 2.0 |
| Number of Rotational Bond | 3.0 |
| Polar Surface Area | 49.69 |
| Heavy Atoms | 7.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 623-39-2 |
| NORMAN SUSDAT | |
| FDA SRS | 4G03VY2NKP |
| ChemSpider | 83791.0 |
CONTENTS
