| Keyword(s): | Smoke compounds ; Plastic additives ; Food Contact Chemicals ; Drinking Water Chemicals |
| Molecule Category | Free-form |
| UNII | B635MZ0ZLU |
| EPA CompTox | DTXSID1026164 |
Structure
| InChI Key | RNVCVTLRINQCPJ-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C7H9N1 |
| Molecular Weight | 107.07 |
| AlogP | 1.58 |
| Hydrogen Bond Acceptor | 1.0 |
| Hydrogen Bond Donor | 1.0 |
| Polar Surface Area | 26.02 |
| Heavy Atoms | 8.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 95-53-4 |
| NORMAN SUSDAT | |
| FDA SRS | B635MZ0ZLU |
| PubChem | 7242 |
| ChemSpider | 13854136.0 |
CONTENTS
