| Record Information |
|---|
| HMDB Status | detected |
|---|
| Creation Date | 2024-02-21 00:01:20 UTC |
|---|
| Update Date | 2025-03-21 18:06:49 UTC |
|---|
| HMDB ID | HMDB0246025 |
|---|
| Metabolite Identification |
|---|
| DeepMet ID | DMID00065336 |
|---|
| Name | 3,4-Dichloroaniline |
|---|
| Frequency | 46.9 |
|---|
| Structure | |
|---|
| Chemical Formula | C6H5Cl2N |
|---|
| Molecular Mass | 160.9799 |
|---|
| SMILES | Nc1ccc(Cl)c(Cl)c1 |
|---|
| InChI Key | SDYWXFYBZPNOFX-UHFFFAOYSA-N |
|---|
| Chemical Taxonomy |
|---|
| Kingdom | organic compounds |
|---|
| Superclass | benzenoids |
|---|
| Class | benzene and substituted derivatives |
|---|
| Subclass | halobenzenes |
|---|
| Direct Parent | dichlorobenzenes |
|---|
| Geometric Descriptor | aromatic homomonocyclic compounds |
|---|
| Alternative Parents | aryl chlorideshydrocarbon derivativesorganochloridesorganopnictogen compoundsprimary amines |
|---|
| Substituents | aryl chlorideorganochlorideorganohalogen compoundaryl halidearomatic homomonocyclic compoundorganonitrogen compoundorganopnictogen compoundhydrocarbon derivative1,2-dichlorobenzeneprimary amineorganic nitrogen compoundamine |
|---|