| Record Information |
|---|
| HMDB Status | detected |
|---|
| Creation Date | 2024-02-21 00:32:32 UTC |
|---|
| Update Date | 2025-03-21 18:42:32 UTC |
|---|
| HMDB ID | HMDB0243848 |
|---|
| Metabolite Identification |
|---|
| DeepMet ID | DMID00139897 |
|---|
| Name | 1-Chlorobutane |
|---|
| Frequency | 17.8 |
|---|
| Structure | |
|---|
| Chemical Formula | C4H9Cl |
|---|
| Molecular Mass | 92.0393 |
|---|
| SMILES | CCCCCl |
|---|
| InChI Key | VFWCMGCRMGJXDK-UHFFFAOYSA-N |
|---|
| Chemical Taxonomy |
|---|
| Kingdom | organic compounds |
|---|
| Superclass | organohalogen compounds |
|---|
| Class | alkyl halides |
|---|
| Subclass | alkyl chlorides |
|---|
| Direct Parent | alkyl chlorides |
|---|
| Geometric Descriptor | aliphatic acyclic compounds |
|---|
| Alternative Parents | hydrocarbon derivativesorganochlorides |
|---|
| Substituents | aliphatic acyclic compoundalkyl chlorideorganochloridehydrocarbon derivative |
|---|
