| Keyword(s): | Food Contact Chemicals |
| Molecule Category | Free-form |
| UNII | W45XXM0XWE |
| EPA CompTox | DTXSID0041224 |
Structure
| InChI Key | ZWVMLYRJXORSEP-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C6H14O3 |
| Molecular Weight | 134.09 |
| AlogP | -0.5 |
| Hydrogen Bond Acceptor | 3.0 |
| Hydrogen Bond Donor | 3.0 |
| Number of Rotational Bond | 5.0 |
| Polar Surface Area | 60.69 |
| Heavy Atoms | 9.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 106-69-4 |
| NORMAN SUSDAT | |
| FDA SRS | W45XXM0XWE |
| PubChem | 7823 |
| ChemSpider | 7535.0 |
CONTENTS
