| Keyword(s): | Drinking Water Chemicals |
| Molecule Category | Free-form |
| UNII | 1VA047EULA |
| EPA CompTox | DTXSID6027894 |
Structure
| InChI Key | ISBHMJZRKAFTGE-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C5H7N |
| Molecular Weight | 81.06 |
| AlogP | 1.48 |
| Hydrogen Bond Acceptor | 1.0 |
| Number of Rotational Bond | 1.0 |
| Polar Surface Area | 23.79 |
| Heavy Atoms | 6.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 26294-98-4 |
| NORMAN SUSDAT | |
| FDA SRS | 1VA047EULA |
| PubChem | 25833 |
| ChemSpider | 24069.0 |
CONTENTS
