Consensus flow list

Identity

Type
NeutralMolecule
CAS
1918-00-9
EC
217-635-6
Origin
EF 3.1 hybrid_name_cas_v1
Changes
58 across every transformer

Structure

Structure diagram for Dicamba

What it is used for

5

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
agrochemical CHEBI:33286 An agrochemical is a substance that is used in agriculture or horticulture. ChEBI
environmental contaminant CHEBI:78298 Any minor or unwanted substance introduced into the environment that can have undesired effects. ChEBI
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
plant growth regulator CHEBI:26155 A chemical, natural or artificial, that can affect the rate of growth of a plant. ChEBI

Alternative labels

20

Properties

PropertyValue
Elemental charge chemrof:elemental_charge 0
InChI2D key string chemrof:inchi2d_key_string IWEDIXLBFLAXBO-UHFFFAOYSA-N
InChI2D string chemrof:inchi2d_string InChI=1S/C8H6Cl2O3/c1-13-7-5(10)3-2-4(9)6(7)8(11)12/h2-3H,1H3,(H,11,12)
IUPAC name chemrof:IUPAC_name 3,6-dichloro-2-methoxybenzoic acid
Molecular formula chemrof:molecular_formula C8H6Cl2O3
Molecular mass chemrof:molecular_mass 221.039
Monoisotopic mass chemrof:monoisotopic_mass 219.969399, 219.9694
SMILES string chemrof:smiles_string COc1c(Cl)ccc(Cl)c1C(=O)O

Known URLs

33

Where 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
agr agr:IND607347510 enrich_references.chebi_xrefs
CAS Common Chemistry https://commonchemistry.cas.org/detail?cas_rn=1918-00-9 enrich_references.chebi_xrefs
ChEBI https://www.ebi.ac.uk/chebi/searchId.do?chebiId=CHEBI:81856 enrich_references.chebi_id_link
chem.echa.europa.eu https://chem.echa.europa.eu/100.016.033 enrich_references.pubchem_identifier_url
chemicalsafety.ilo.org https://chemicalsafety.ilo.org/dyn/icsc/showcard.display?p_card_id=0139 enrich_references.pubchem_identifier_url
comptox.epa.gov https://comptox.epa.gov/dashboard/DTXSID4024018 enrich_references.pubchem_identifier_url
ebi.ac.uk https://www.ebi.ac.uk/chembl/explore/compound/CHEMBL476936 enrich_references.pubchem_identifier_url
gsrs.ncats.nih.gov https://gsrs.ncats.nih.gov/ginas/app/beta/substances/SJG3M6RY6H enrich_references.pubchem_identifier_url
HMDB https://hmdb.ca/metabolites/HMDB0251180 enrich_references.chebi_xrefs
jglobal.jst.go.jp http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J3.382K enrich_references.pubchem_identifier_url
KEGG https://www.genome.jp/entry/C18597 enrich_references.chebi_xrefs
kegg.jp https://www.kegg.jp/entry/C18597 enrich_references.pubchem_identifier_url
metabolomicsworkbench.org https://www.metabolomicsworkbench.org/data/StructureData.php?RegNo=143629 enrich_references.pubchem_identifier_url
patent patent:US2014329681 enrich_references.chebi_xrefs
pdb-ccd pdb-ccd:D3M enrich_references.chebi_xrefs
pesticides pesticides:dicamba enrich_references.chebi_xrefs
ppdb ppdb:213 enrich_references.chebi_xrefs
PubChem https://pubchem.ncbi.nlm.nih.gov/compound/3030 enrich_references.pubchem_compound
PubChem https://pubchem.ncbi.nlm.nih.gov/erg/#3077 enrich_references.pubchem_identifier_url
PubChem https://pubchem.ncbi.nlm.nih.gov/erg/#3082 enrich_references.pubchem_identifier_url
PubMed https://pubmed.ncbi.nlm.nih.gov/23726069 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/24351123 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/24420721 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/34817161 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/35170207 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/35926599 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/36033860 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/36181421 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/36205187 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/36297822 enrich_references.chebi_xrefs
reaxys reaxys:2453039 enrich_references.chebi_xrefs
wikidata.org https://www.wikidata.org/wiki/Q424684 enrich_references.pubchem_identifier_url
Wikipedia https://en.wikipedia.org/wiki/Dicamba enrich_references.chebi_xrefs

Elementary flows

16
Flow Context Source Unit CFs
1f30fd60-6556-11dd-ad8b-0800200c9a66 Environmental → Air → Aircraft cruise height EF 3.1 kg 4
fe0acd60-3ddc-11dd-a986-0050c2490048 Environmental → Air → Ground level → Urban (>1000 people/square mile) EF 3.1 kg 4
48dda933-9f27-48b3-95c4-53240c2807dc Environmental → Air → Indoor EF 3.1 kg 4
fe0acd60-3ddc-11dd-a985-0050c2490048 Environmental → Air → Long-term EF 3.1 kg 0
fe0acd60-3ddc-11dd-a987-0050c2490048 Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) EF 3.1 kg 4
fe0acd60-3ddc-11dd-a984-0050c2490048 Environmental → Air → Unknown EF 3.1 kg 4
fe0acd60-3ddc-11dd-a982-0050c2490048 Environmental → Ground → Agricultural EF 3.1 kg 4
4d9a8790-3ddd-11dd-982b-0050c2490048 Environmental → Ground → Non-agricultural EF 3.1 kg 4
d4b21c375b9c125d1ba1cca63e9487f349195ca2 Environmental → Ground → Silvicultural ecoinvent algorithm addition kg 0
fe0acd60-3ddc-11dd-a983-0050c2490048 Environmental → Ground → Unknown EF 3.1 kg 4
fe0acd60-3ddc-11dd-a989-0050c2490048 Environmental → Water → Long-term EF 3.1 kg 0
4d9a8790-3ddd-11dd-982c-0050c2490048 Environmental → Water → Ocean EF 3.1 kg 4
9a4cd850460fa430c6c7c2cc7847f9a06a3b2cca Environmental → Water → River bafu algorithm addition kg 0
fe0acd60-3ddc-11dd-a988-0050c2490048 Environmental → Water → Surface water EF 3.1 kg 4
b0bbfb225eae9e898293dae524966980f8b22adf Environmental → Water → Unconfined aquifer ecoinvent algorithm addition kg 0
4d9a8790-3ddd-11dd-982a-0050c2490048 Environmental → Water → Unknown EF 3.1 kg 4

History

Everything that changed this substance (58 changes)

Open the changes page

Full record

Flow object JSON
{
  "flow_object_id": "fo-a2783b297c3dff86",
  "prefLabel": [
    {
      "@value": "Dicamba",
      "@language": "en",
      "@lang": "en",
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        ],
        "prov:wasDerivedFrom": "legacy name field"
      }
    }
  ],
  "altLabel": [
    {
      "@value": "2,5-Dichloro-6-methoxybenzoic acid",
      "@language": "en",
      "@lang": "en",
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        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "2-Methoxy-3,6-dichlorobenzoic acid",
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      "provenance": {
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      }
    },
    {
      "@value": "3,6-dichloro-2-methoxybenzoic acid",
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        "prov:wasDerivedFrom": "chebi synonym match"
      }
    },
    {
      "@value": "3,6-dichloro-o-anisic acid",
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    },
    {
      "@value": "Aviator",
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    },
    {
      "@value": "Banvel",
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    },
    {
      "@value": "Banvel 70WP",
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    },
    {
      "@value": "Banvel SGF",
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        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Benzoic acid, 3,6-dichloro-2-methoxy-",
      "@language": "en",
      "@lang": "en",
      "provenance": {
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        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Celebrity B",
      "@language": "en",
      "@lang": "en",
      "provenance": {
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        "prov:wasAttributedTo": "consensus-flow-list",
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        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "DC",
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        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Dianat",
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      }
    },
    {
      "@value": "Mais Banvel WG",
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        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "MDBA",
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      "@lang": "en",
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        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Mediben",
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      "@lang": "en",
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        ],
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      }
    },
    {
      "@value": "MeSH ID: D003996",
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      "@lang": "en",
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          "https://commonchemistry.cas.org/detail?cas_rn=1918-00-9"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "o-Anisic acid, 3,6-dichloro-",
      "@language": "en",
      "@lang": "en",
      "provenance": {
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        "prov:wasAttributedTo": "consensus-flow-list",
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          "https://commonchemistry.cas.org/detail?cas_rn=1918-00-9"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Vanquish",
      "@language": "en",
      "@lang": "en",
      "provenance": {
        "prov:wasGeneratedBy": "consensus_match",
        "prov:wasAttributedTo": "consensus-flow-list",
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          "https://commonchemistry.cas.org/detail?cas_rn=1918-00-9"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Velsicol 58CS11",
      "@language": "en",
      "@lang": "en",
      "provenance": {
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        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Velsicol Compound R",
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  ],
  "properties": {
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