| Keyword(s): | Food Contact Chemicals ; Drinking Water Chemicals ; Plastic additives |
| Molecule Category | Free-form |
| UNII | 6E1I4IV47V |
| EPA CompTox | DTXSID7022128 |
Structure
| InChI Key | WOBHKFSMXKNTIM-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C6H10O3 |
| Molecular Weight | 130.06 |
| AlogP | 0.1 |
| Hydrogen Bond Acceptor | 3.0 |
| Hydrogen Bond Donor | 1.0 |
| Number of Rotational Bond | 3.0 |
| Polar Surface Area | 46.53 |
| Heavy Atoms | 9.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 868-77-9 |
| NORMAN SUSDAT | |
| FDA SRS | 6E1I4IV47V |
| PubChem | 13360 |
| ChemSpider | 12791.0 |
CONTENTS
