| Keyword(s): | Plastic additives ; Food Contact Chemicals |
| Molecule Category | Free-form |
| UNII | P601A79G79 |
| EPA CompTox | DTXSID2021608 |
Structure
| InChI Key | PFCHFHIRKBAQGU-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C6H12O1 |
| Molecular Weight | 100.09 |
| AlogP | 1.77 |
| Hydrogen Bond Acceptor | 1.0 |
| Number of Rotational Bond | 3.0 |
| Polar Surface Area | 17.07 |
| Heavy Atoms | 7.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 589-38-8 |
| NORMAN SUSDAT | |
| FDA SRS | P601A79G79 |
| PubChem | 11509 |
| ChemSpider | 11025.0 |
CONTENTS
