| Record Information |
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| HMDB Status | detected |
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| Creation Date | 2024-02-20 23:43:09 UTC |
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| Update Date | 2025-03-21 17:59:39 UTC |
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| HMDB ID | HMDB0246404 |
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| Metabolite Identification |
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| DeepMet ID | DMID00022354 |
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| Name | 4-Chlorotoluene |
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| Frequency | 177.5 |
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| Structure | |
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| Chemical Formula | C7H7Cl |
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| Molecular Mass | 126.0236 |
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| SMILES | Cc1ccc(Cl)cc1 |
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| InChI Key | NPDACUSDTOMAMK-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | benzenoids |
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| Class | benzene and substituted derivatives |
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| Subclass | halobenzenes |
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| Direct Parent | chlorobenzenes |
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| Geometric Descriptor | aromatic homomonocyclic compounds |
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| Alternative Parents | aryl chlorideshydrocarbon derivativesorganochloridestoluenes |
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| Substituents | aryl chloridechlorobenzenearomatic homomonocyclic compoundorganochloridehydrocarbon derivativeorganohalogen compoundtoluenearyl halide |
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