| Record Information |
|---|
| HMDB Status | detected |
|---|
| Creation Date | 2024-02-20 23:53:01 UTC |
|---|
| Update Date | 2025-03-21 18:03:40 UTC |
|---|
| HMDB ID | HMDB0250107 |
|---|
| Metabolite Identification |
|---|
| DeepMet ID | DMID00045783 |
|---|
| Name | Chloroacetone |
|---|
| Frequency | 73.4 |
|---|
| Structure | |
|---|
| Chemical Formula | C3H5ClO |
|---|
| Molecular Mass | 92.0029 |
|---|
| SMILES | CC(=O)CCl |
|---|
| InChI Key | BULLHNJGPPOUOX-UHFFFAOYSA-N |
|---|
| Chemical Taxonomy |
|---|
| Kingdom | organic compounds |
|---|
| Superclass | organic oxygen compounds |
|---|
| Class | organooxygen compounds |
|---|
| Subclass | carbonyl compounds |
|---|
| Direct Parent | alpha-chloroketones |
|---|
| Geometric Descriptor | aliphatic acyclic compounds |
|---|
| Alternative Parents | alkyl chlorideshydrocarbon derivativesorganic oxidesorganochlorides |
|---|
| Substituents | aliphatic acyclic compoundalkyl chlorideorganochlorideorganohalogen compoundalpha-chloroketoneorganic oxidealkyl halidehydrocarbon derivative |
|---|
