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Sulcofuron-sodium

fo-f3de3ceaad9c55e6

Identity

Type
Chemical salt
CAS
3567-25-7
EC
222-654-8
Origin
EF 3.1 hybrid_name_cas_v1
Changes
60 across every transformer

Structure

Structure diagram for Sulcofuron-sodium

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
insecticide CHEBI:24852 Strictly, a substance intended to kill members of the class Insecta. In common usage, any substance used for preventing, destroying, repelling or controlling insects. 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

15

Properties

PropertyValue
Elemental charge chemrof:elemental_charge 0
InChI2D key string chemrof:inchi2d_key_string NMGNJWORLGLLHQ-UHFFFAOYSA-M
InChI2D string chemrof:inchi2d_string InChI=1S/C19H12Cl4N2O5S.Na/c20-10-1-5-16(30-17-6-2-11(21)8-18(17)31(27,28)29)15(7-10)25-19(26)24-12-3-4-13(22)14(23)9-12;/h1-9H,(H2,24,25,26)(H,27,28,29);/q;+1/p-1
IUPAC name chemrof:IUPAC_name Sodium 5-chloro-2-(4-chloro-2-((((3,4-dichlorophenyl)amino)carbonyl)amino)phenoxy)benzenesulphonate
Molecular formula chemrof:molecular_formula C19H11Cl4N2NaO5S, C19H11Cl4N2O5S.Na
Molecular mass chemrof:molecular_mass 544.175
Monoisotopic mass chemrof:monoisotopic_mass 541.904047, 541.90405
SMILES string chemrof:smiles_string O=C(Nc1ccc(Cl)c(Cl)c1)Nc1cc(Cl)ccc1Oc1ccc(Cl)cc1S(=O)(=O)[O-].[Na+]

Known URLs

9

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
CAS Common Chemistry https://commonchemistry.cas.org/detail?cas_rn=3567-25-7 enrich_references.chebi_xrefs
ChEBI https://www.ebi.ac.uk/chebi/searchId.do?chebiId=CHEBI:59247 enrich_references.chebi_id_link
chem.echa.europa.eu https://chem.echa.europa.eu/100.020.595 enrich_references.pubchem_identifier_url
comptox.epa.gov https://comptox.epa.gov/dashboard/DTXSID6034899 enrich_references.pubchem_identifier_url
gsrs.ncats.nih.gov https://gsrs.ncats.nih.gov/ginas/app/beta/substances/26R1Z8PQVH enrich_references.pubchem_identifier_url
PubChem https://pubchem.ncbi.nlm.nih.gov/compound/23669621 enrich_references.pubchem_compound
PubMed https://pubmed.ncbi.nlm.nih.gov/8841454 enrich_references.chebi_xrefs
reaxys reaxys:14188156 enrich_references.chebi_xrefs
Wikidata https://www.wikidata.org/wiki/Q27126567 enrich_references.pubchem_identifier_url

Elementary flows

13
Flow Context Source Unit CFs
73c79d18-e634-4374-a1d3-aa65f860eb1e Environmental → Air → Aircraft cruise height EF 3.1 kg 2
84641e2b-9ec0-4c98-a578-f85fdb77b536 Environmental → Air → Ground level → Urban (>1000 people/square mile) EF 3.1 kg 2
57a150e0-cd33-45dd-b3bc-2afafee53d0a Environmental → Air → Indoor EF 3.1 kg 2
d8620a06-fd3e-4fcc-b0ad-377f67cfcc03 Environmental → Air → Long-term EF 3.1 kg 0
719f4708-bcb1-4a2e-9b8d-36f359491c9d Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) EF 3.1 kg 2
b107dae0-a84f-4e8f-8d7c-5c5c71b32cd3 Environmental → Air → Unknown EF 3.1 kg 2
212f66db-152a-4545-8fd4-c57bc68ab45f Environmental → Ground → Agricultural EF 3.1 kg 2
577adb59-4c1f-4f0c-9159-23832f4b4f3e Environmental → Ground → Non-agricultural EF 3.1 kg 2
4cff47c3-76ae-463b-b5f9-4bcfbc064b49 Environmental → Ground → Unknown EF 3.1 kg 2
e3427c39-be48-4754-b388-a3e6e221e3be Environmental → Water → Long-term EF 3.1 kg 0
28dbb580-1fe1-411d-985e-ce9b5cb77e0b Environmental → Water → Ocean EF 3.1 kg 2
2b0db909-826b-48eb-9fcb-8e1190718159 Environmental → Water → Surface water EF 3.1 kg 2
7bdc61af-f880-4a90-ac62-6f32f591b723 Environmental → Water → Unknown EF 3.1 kg 2

History

Everything that changed this substance (60 changes)

Open the changes page

Full record

Flow object JSON 
{
  "flow_object_id": "fo-f3de3ceaad9c55e6",
  "prefLabel": [
    {
      "@value": "Sulcofuron-sodium",
      "@language": "en",
      "@lang": "en",
      "provenance": {
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          "EF 3.1"
        ],
        "prov:wasDerivedFrom": "Common Chemistry / ChEBI primary name agreement"
      }
    }
  ],
  "altLabel": [
    {
      "@value": "Benzenesulfonic acid, 5-chloro-2-[4-chloro-2-[3-(3,4-dichlorophenyl)ureido]phenoxy]-, monosodium salt",
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        ],
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      }
    },
    {
      "@value": "Benzenesulfonic acid, 5-chloro-2-[4-chloro-2-[3-(3,4-dichlorophenyl)ureido]phenoxy]-, sodium salt",
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      }
    },
    {
      "@value": "Benzenesulfonic acid, 5-chloro-2-[4-chloro-2-[[[(3,4-dichlorophenyl)amino]carbonyl]amino]phenoxy]-, monosodium salt",
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        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Benzenesulfonic acid, 5-chloro-2-[4-chloro-2-[[[(3,4-dichlorophenyl)amino]carbonyl]amino]phenoxy]-, sodium salt (1:1)",
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        ],
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      }
    },
    {
      "@value": "Mitin FF",
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      }
    },
    {
      "@value": "N-(3,4-Dichlorophenyl)-N'-2-(2-sulfo-4-chlorophenoxy)-5-chlorophenyl urea sodium salt",
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    },
    {
      "@value": "N-3,4-Dichlorophenyl N-5-chloro-2-(2-sodium sulfonyl-4-chlorophenoxy)phenyl urea",
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      }
    },
    {
      "@value": "N-3,4-Dichlorophenyl N′-5-chloro-2-(2-sodium sulfonyl-4-chlorophenoxy)phenyl urea",
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      }
    },
    {
      "@value": "Sodium 5-chloro-2-(4-chloro-2-((((3,4-dichlorophenyl)amino)carbonyl)amino)phenoxy)benzenesulphonate",
      "@language": "en",
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      "provenance": {
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      }
    },
    {
      "@value": "Sodium 5-chloro-2-(4-chloro-2-(3-(3,4-dichlorophenyl)-ureido)phenoxy)benzenesulfonate",
      "@language": "en",
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        ],
        "prov:wasDerivedFrom": "chebi synonym match"
      }
    },
    {
      "@value": "sodium 5-chloro-2-(4-chloro-2-{[(3,4-dichlorophenyl)carbamoyl]amino}phenoxy)benzene-1-sulfonate",
      "@language": "en",
      "@lang": "en",
      "provenance": {
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      }
    },
    {
      "@value": "Sodium 5-chloro-2-[4-chloro-2-[[[(3,4-dichlorophenyl)amino]carbonyl]amino]phenoxy]benzenesulphonate",
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        "prov:hadPrimarySource": [
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        "prov:wasDerivedFrom": "original name retained as altLabel"
      }
    },
    {
      "@value": "Sodium chloro-2-(4-chloro-2-(3-(3,4-dichlorophenyl)ureido)phenoxy) benzenesulfonate",
      "@language": "en",
      "@lang": "en",
      "provenance": {
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        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Sodium salt of N-(3,4-dichlorophenyl)-N′-2-(2-sulfo-4-chlorophenoxy)-5-chlorophenylurea",
      "@language": "en",
      "@lang": "en",
      "provenance": {
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        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Sulcofuron",
      "@language": "en",
      "@lang": "en",
      "provenance": {
        "prov:wasGeneratedBy": "chebi_altlabels",
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        ],
        "prov:wasDerivedFrom": "chebi synonym match"
      }
    }
  ],
  "properties": {
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      "@id": "https://w3id.org/chemrof/molecular_formula",
      "@value": [
        "C19H11Cl4N2NaO5S",
        "C19H11Cl4N2O5S.Na"
      ],
      "attested_by": {
        "C19H11Cl4N2O5S.Na": [
          "enrich_references.chebi_semantic"
        ],
        "C19H11Cl4N2NaO5S": [
          "enrich_references.pubchem_semantic",
          "rdkit_post_consensus"
        ]
      },
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        },
        {
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            "O=C(Nc1ccc(Cl)c(Cl)c1)Nc1cc(Cl)ccc1Oc1ccc(Cl)cc1S(=O)(=O)[O-].[Na+]"
          ]
        }
      ]
    },
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      "@id": "https://w3id.org/chemrof/smiles_string",
      "rdfs:label": "SMILES",
      "@value": [
        "O=C(Nc1ccc(Cl)c(Cl)c1)Nc1cc(Cl)ccc1Oc1ccc(Cl)cc1S(=O)(=O)[O-].[Na+]"
      ],
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        {
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          ]
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      ],
      "attested_by": {
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    "https://w3id.org/chemrof/inchi2d_string": {
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      "@value": [
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        }
      ],
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    },
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      "@id": "https://w3id.org/chemrof/molecular_mass",
      "@value": [
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        }
      ]
    },
    "https://w3id.org/chemrof/monoisotopic_mass": {
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          "prov:hadPrimarySource": [
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          ]
        },
        {
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          "prov:hadPrimarySource": [
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          ]
        }
      ]
    },
    "https://w3id.org/chemrof/elemental_charge": {
      "@id": "https://w3id.org/chemrof/elemental_charge",
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      "attested_by": {
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