| Keyword(s): | Food Contact Chemicals ; Plastic additives |
| Molecule Category | Free-form |
| EPA CompTox | DTXSID60346991 |
Structure
| InChI Key | GVKJWGRAPDVEMC-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C14H21NO3 |
| Molecular Weight | 251.15 |
| AlogP | 3.9 |
| Hydrogen Bond Acceptor | 3.0 |
| Hydrogen Bond Donor | 1.0 |
| Number of Rotational Bond | 1.0 |
| Polar Surface Area | 63.37 |
| Heavy Atoms | 18.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 20039-94-5 |
| NORMAN SUSDAT |
CONTENTS
