2,6-dichlorobenzamide
fo-2632208f0d7d9bb8
Identity
- Type
- Neutral molecule
- CAS
- 2008-58-4
- EC
- 217-918-4
- Origin
- EF 3.1 hybrid_name_cas_v1
- Changes
- 57 across every transformer
Structure
What it is used for
2
Roles, not types. A substance bears as many as apply — sulfluramid is an
insecticide and an acaricide — and each is a class ChEBI curates, asserted
with ChEBI’s own has role. The narrow ones publish the broad
ones alongside them, so a substance filed as a herbicide is a pesticide
here too. See agricultural
chemicals for what the axis is and which classes are published.
| Role | Definition | Evidence |
|---|---|---|
| herbicide CHEBI:24527 | A substance used to destroy plant pests. | ChEBI |
| pesticide CHEBI:25944 | Strictly, a substance intended to kill pests. In common usage, any substance used for controlling, preventing, or destroying animal, microbiological or plant pests. | ChEBI |
Alternative labels
5- 2,6-BAM
- 2,6-dichlorobenzoic acid amide
- AE-C 653711
- BAM
- Benzamide, 2,6-dichloro-
Properties
| Property | Value |
|---|---|
| Elemental charge chemrof:elemental_charge | 0 |
| InChI2D key string chemrof:inchi2d_key_string | JHSPCUHPSIUQRB-UHFFFAOYSA-N |
| InChI2D string chemrof:inchi2d_string | InChI=1S/C7H5Cl2NO/c8-4-2-1-3-5(9)6(4)7(10)11/h1-3H,(H2,10,11) |
| IUPAC name chemrof:IUPAC_name | 2,6-dichlorobenzamide |
| Molecular formula chemrof:molecular_formula | C7H5Cl2NO |
| Molecular mass chemrof:molecular_mass | 190.029 |
| Monoisotopic mass chemrof:monoisotopic_mass | 188.974819, 188.97482 |
| SMILES string chemrof:smiles_string | NC(=O)c1c(Cl)cccc1Cl |
Known URLs
15Where else this substance is described. Collected while the pipeline resolved it — from ChEBI's cross-references, from PubChem's identifier list, and from the CAS number — so a link here is a record the merge actually read, not a search it suggests.
| Resource | URL | Recorded by |
|---|---|---|
| CAS Common Chemistry | https://commonchemistry.cas.org/detail?cas_rn=2008-58-4 | enrich_references.chebi_xrefs |
| ChEBI | https://www.ebi.ac.uk/chebi/searchId.do?chebiId=CHEBI:28435 | enrich_references.chebi_id_link |
| chem.echa.europa.eu | https://chem.echa.europa.eu/100.016.291 | enrich_references.pubchem_identifier_url |
| comptox.epa.gov | https://comptox.epa.gov/dashboard/DTXSID7022170 | enrich_references.pubchem_identifier_url |
| dtp.cancer.gov | https://dtp.cancer.gov/dtpstandard/servlet/dwindex?searchtype=NSC&outputformat=html&searchlist=53137 | enrich_references.pubchem_identifier_url |
| ebi.ac.uk | https://www.ebi.ac.uk/chembl/explore/compound/CHEMBL3184754 | enrich_references.pubchem_identifier_url |
| gsrs.ncats.nih.gov | https://gsrs.ncats.nih.gov/ginas/app/beta/substances/E9JWF529EB | enrich_references.pubchem_identifier_url |
| jglobal.jst.go.jp | http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J29.504C | enrich_references.pubchem_identifier_url |
| KEGG | https://www.genome.jp/entry/C10934 | enrich_references.chebi_xrefs |
| kegg.jp | https://www.kegg.jp/entry/C10934 | enrich_references.pubchem_identifier_url |
| metabolomicsworkbench.org | https://www.metabolomicsworkbench.org/data/StructureData.php?RegNo=51717 | enrich_references.pubchem_identifier_url |
| PubChem | https://pubchem.ncbi.nlm.nih.gov/compound/16183 | enrich_references.pubchem_compound |
| PubMed | https://pubmed.ncbi.nlm.nih.gov/16515829 | enrich_references.chebi_xrefs |
| reaxys | reaxys:1869103 | enrich_references.chebi_xrefs |
| Wikidata | https://www.wikidata.org/wiki/Q27103696 | enrich_references.pubchem_identifier_url |
Elementary flows
13| Flow | Context | Source | Unit | CFs |
|---|---|---|---|---|
| 73a4789a-c434-4d18-bb60-0d346017b3d7 | Environmental → Air → Aircraft cruise height | EF 3.1 | kg | 4 |
| 325f960f-ceaf-4051-b03b-2cc4615f99af | Environmental → Air → Ground level → Urban (>1000 people/square mile) | EF 3.1 | kg | 4 |
| 768c7acc-9330-4bb1-af42-32c4fbaa1616 | Environmental → Air → Indoor | EF 3.1 | kg | 4 |
| 61693a07-817f-4aae-81df-f65c43a6ef6c | Environmental → Air → Long-term | EF 3.1 | kg | 0 |
| 5bd0e04f-2ed2-4abe-ad08-f455e6cff24f | Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) | EF 3.1 | kg | 4 |
| 071e80c7-edfd-4f9a-898f-7a9d700cac8e | Environmental → Air → Unknown | EF 3.1 | kg | 4 |
| 5c6cea75-bd2a-4f79-8f4d-d7d4606000cf | Environmental → Ground → Agricultural | EF 3.1 | kg | 4 |
| 7b9de16a-94bb-434f-aefb-cb4017c7b3ed | Environmental → Ground → Non-agricultural | EF 3.1 | kg | 4 |
| 2eb81e20-520e-4f3e-916a-07b997844a29 | Environmental → Ground → Unknown | EF 3.1 | kg | 4 |
| 983a28e7-abb9-4f72-bef7-6a00169bf080 | Environmental → Water → Long-term | EF 3.1 | kg | 0 |
| b1447209-ff6c-4ced-b1be-9fba54404359 | Environmental → Water → Ocean | EF 3.1 | kg | 4 |
| 5f1d85cc-6bd6-4f1e-bc72-a1efb310e71c | Environmental → Water → Surface water | EF 3.1 | kg | 4 |
| c5b91336-41a2-4bc9-a9e9-70e6e4d1ef60 | Environmental → Water → Unknown | EF 3.1 | kg | 4 |
History
Everything that changed this substance (57 changes)
Full record
Flow object JSON
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"@id": "https://commonchemistry.cas.org/detail?cas_rn=2008-58-4"
}
],
"provenance": {
"prov:wasGeneratedBy": "hybrid_name_cas_v1",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"EF 3.1"
],
"prov:wasDerivedFrom": "cas_numbers"
}
},
"http://semanticscience.org/resource/CHEMINF_000447": {
"@value": [
"217-918-4"
],
"rdfs:seeAlso": [
"https://echa.europa.eu/search-for-chemicals?query=217-918-4"
],
"provenance": {
"prov:wasGeneratedBy": "hybrid_name_cas_v1",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"EF 3.1"
],
"prov:wasDerivedFrom": "ec_numbers"
}
}
},
"origin_qualifier": null,
"parent_flow_object_id": null,
"parent_intervention_id": null,
"http://www.w3.org/2004/02/skos/core#definition": [
{
"@value": "A member of the class of benzamides that is benzamide substituted by chloro groups at positions 2 and 6.",
"@language": "en",
"provenance": {
"prov:wasGeneratedBy": "enrich_references.chebi_definition",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"http://purl.obolibrary.org/obo/CHEBI_28435"
],
"prov:wasDerivedFrom": "chebi.definition"
}
}
],
"@type": [
"https://w3id.org/chemrof/NeutralMolecule"
],
"http://purl.obolibrary.org/obo/RO_0000087": [
{
"@id": "http://purl.obolibrary.org/obo/CHEBI_24527",
"rdfs:label": "herbicide",
"http://www.w3.org/2004/02/skos/core#definition": "A substance used to destroy plant pests.",
"provenance": {
"prov:wasGeneratedBy": "chebi_roles",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"ChEBI"
],
"prov:wasDerivedFrom": "http://semanticscience.org/resource/CHEMINF_000446 -> ChEBI RO:0000087"
}
},
{
"@id": "http://purl.obolibrary.org/obo/CHEBI_25944",
"rdfs:label": "pesticide",
"http://www.w3.org/2004/02/skos/core#definition": "Strictly, a substance intended to kill pests. In common usage, any substance used for controlling, preventing, or destroying animal, microbiological or plant pests.",
"provenance": {
"prov:wasGeneratedBy": "chebi_roles",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"ChEBI"
],
"prov:wasDerivedFrom": "http://semanticscience.org/resource/CHEMINF_000446 -> ChEBI RO:0000087"
}
}
]
}Something wrong here?
- This substance is published under the wrong name
- This is not that chemical
- This record is two substances, or it is a second copy of one
You do not need to run a build or clone anything. Name the record and say what your evidence is; the measurement is done for you. How contributing works