| Record Information |
|---|
| HMDB Status | expected |
|---|
| Creation Date | 2024-02-21 00:13:24 UTC |
|---|
| Update Date | 2025-03-21 18:33:05 UTC |
|---|
| HMDB ID | HMDB0059882 |
|---|
| Metabolite Identification |
|---|
| DeepMet ID | DMID00094194 |
|---|
| Name | Benzyl chloride |
|---|
| Frequency | 29.5 |
|---|
| Structure | |
|---|
| Chemical Formula | C7H7Cl |
|---|
| Molecular Mass | 126.0236 |
|---|
| SMILES | ClCc1ccccc1 |
|---|
| InChI Key | KCXMKQUNVWSEMD-UHFFFAOYSA-N |
|---|
| Chemical Taxonomy |
|---|
| Kingdom | organic compounds |
|---|
| Superclass | benzenoids |
|---|
| Class | benzene and substituted derivatives |
|---|
| Subclass | benzyl halides |
|---|
| Direct Parent | benzyl chlorides |
|---|
| Geometric Descriptor | aromatic homomonocyclic compounds |
|---|
| Alternative Parents | alkyl chlorideshydrocarbon derivativesorganochlorides |
|---|
| Substituents | aromatic homomonocyclic compoundalkyl chlorideorganochloridealkyl halidehydrocarbon derivativeorganohalogen compoundbenzyl chloride |
|---|