Captafol

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
fungicide CHEBI:24127	A substance used to destroy fungal 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

(tetrachloroethylthio)tetrahydrophthalimide
1,2,3,6-tetrahydro-N-(1,1,2,2-tetrachloroethylthio)phthalimide
1H-Isoindole-1,3(2H)-dione, 3a,4,7,7a-tetrahydro-2-[(1,1,2,2-tetrachloroethyl)thio]-
2-[(1,1,2,2-tetrachloroethyl)sulfanyl]-3a,4,7,7a-tetrahydro-1H-isoindole-1,3(2H)-dione
3a,4,7,7a-tetrahydro-2-[(1,1,2,2-tetrachloroethyl)thio]-1H-isoindole-1,3(2H)-dione
3a,4,7,7a-tetrahydro-N-(1,1,2,2-tetrachloroethanesulphenyl)phthalimide
4-Cyclohexene-1,2-dicarboximide, N-[(1,1,2,2-tetrachloroethyl)thio]-
Arborseal
Captaspor
Difolatan
Difolatan 4F
Difolatan 4F1
Difolatan 80W
Difolatan BOW
Difosan
Folcid
Foltaf
Haipen
Haipen 50
Kenofol
Merpafol
N-(1,1,2,2-Tetrachloroethylthio)-4-cyclohexene-1,2-dicarboximide
N-(1,1,2,2-Tetrachloroethylthio)-4-cyclohexene-1,2-dicarboxyimide
N-(1,1,2,2-tetrachloroethylthio)-Delta(4)-tetrahydrophthalimide
N-(1,1,2,2-Tetrachloroethylthio)-Δ4-tetrahydrophthalimide
N-(Tetrachloroethylthio)tetrahydrophthalimide
N-1,1,2,2-tetrachloroethylmercapto-4-cyclohexene-1,2-carboximide
N-1,1,2,2-Tetrachloroethylmercapto-4-cyclohexene-1,2-dicarboximide
N-[(1,1,2,2-tetrachloroethyl)sulfenyl]-4-cyclohexene-1,2-dicarboximide
Proxel EF
Sanspor
Santar SM
Terrazol
Tetrachloroethylthiotetrahydrophthalimide

Property	Value
Elemental charge chemrof:elemental_charge	0
InChI2D key string chemrof:inchi2d_key_string	JHRWWRDRBPCWTF-UHFFFAOYSA-N
InChI2D string chemrof:inchi2d_string	InChI=1S/C10H9Cl4NO2S/c11-9(12)10(13,14)18-15-7(16)5-3-1-2-4-6(5)8(15)17/h1-2,5-6,9H,3-4H2
IUPAC name chemrof:IUPAC_name	1,2,3,6-tetrahydro-N-(1,1,2,2-tetrachloroethylthio)phthalimide
Molecular formula chemrof:molecular_formula	C10H9Cl4NO2S
Molecular mass chemrof:molecular_mass	349.066
Monoisotopic mass chemrof:monoisotopic_mass	346.91081
SMILES string chemrof:smiles_string	O=C1C2CC=CCC2C(=O)N1SC(Cl)(Cl)C(Cl)Cl

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=2425-06-1	enrich_references.chebi_xrefs
cdc.gov	https://www.cdc.gov/niosh-rtecs/GW4AC4A0.html	enrich_references.pubchem_identifier_url
ChEBI	https://www.ebi.ac.uk/chebi/searchId.do?chebiId=CHEBI:81938	enrich_references.chebi_id_link
chem.echa.europa.eu	https://chem.echa.europa.eu/100.017.604	enrich_references.pubchem_identifier_url
chemicalsafety.ilo.org	https://chemicalsafety.ilo.org/dyn/icsc/showcard.display?p_card_id=0119	enrich_references.pubchem_identifier_url
comptox.epa.gov	https://comptox.epa.gov/dashboard/DTXSID4020242	enrich_references.pubchem_identifier_url
ebi.ac.uk	https://www.ebi.ac.uk/chembl/explore/compound/CHEMBL1893263	enrich_references.pubchem_identifier_url
HMDB	https://hmdb.ca/metabolites/HMDB0031669	enrich_references.chebi_xrefs
jglobal.jst.go.jp	http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J3.026K	enrich_references.pubchem_identifier_url
KEGG	https://www.genome.jp/entry/C18754	enrich_references.chebi_xrefs
kegg.jp	https://www.kegg.jp/entry/C18754	enrich_references.pubchem_identifier_url
metabolomicsworkbench.org	https://www.metabolomicsworkbench.org/data/StructureData.php?RegNo=45028	enrich_references.pubchem_identifier_url
ncithesaurus.nci.nih.gov	https://ncithesaurus.nci.nih.gov/ncitbrowser/ConceptReport.jsp?dictionary=NCI_Thesaurus&ns=ncit&code=C77381	enrich_references.pubchem_identifier_url
patent	patent:BE633205	enrich_references.chebi_xrefs
pesticides	pesticides:captafol	enrich_references.chebi_xrefs
ppdb	ppdb:113	enrich_references.chebi_xrefs
PubChem	https://pubchem.ncbi.nlm.nih.gov/compound/17038	enrich_references.pubchem_compound
PubMed	https://pubmed.ncbi.nlm.nih.gov/159800	enrich_references.chebi_xrefs
PubMed	https://pubmed.ncbi.nlm.nih.gov/1842583	enrich_references.chebi_xrefs
PubMed	https://pubmed.ncbi.nlm.nih.gov/21822319	enrich_references.chebi_xrefs
PubMed	https://pubmed.ncbi.nlm.nih.gov/8426061	enrich_references.chebi_xrefs
reaxys	reaxys:1543712	enrich_references.chebi_xrefs
reaxys	reaxys:234872	enrich_references.chebi_xrefs
Wikidata	https://www.wikidata.org/wiki/Q63088167	enrich_references.pubchem_identifier_url
Wikipedia	https://en.wikipedia.org/wiki/Captafol	enrich_references.chebi_xrefs

Flow	Context	Source	Unit	CFs
1f314b6e-6556-11dd-ad8b-0800200c9a66	Environmental → Air → Aircraft cruise height	EF 3.1	kg	4
fe0acd60-3ddc-11dd-ae8a-0050c2490048	Environmental → Air → Ground level → Urban (>1000 people/square mile)	EF 3.1	kg	4
65e0a3c8-aedf-4bad-8e0c-9ec2d575b2d2	Environmental → Air → Indoor	EF 3.1	kg	4
fe0acd60-3ddc-11dd-ae89-0050c2490048	Environmental → Air → Long-term	EF 3.1	kg	0
fe0acd60-3ddc-11dd-ae8b-0050c2490048	Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile)	EF 3.1	kg	4
fe0acd60-3ddc-11dd-ae88-0050c2490048	Environmental → Air → Unknown	EF 3.1	kg	4
08a91e70-3ddc-11dd-9236-0050c2490048	Environmental → Ground → Agricultural	EF 3.1	kg	4
fe0acd60-3ddc-11dd-ae8f-0050c2490048	Environmental → Ground → Non-agricultural	EF 3.1	kg	4
652a9591c2d0ed399a3ddc445f0cfb6e3853747d	Environmental → Ground → Silvicultural	ecoinvent algorithm addition	kg	0
fe0acd60-3ddc-11dd-ae87-0050c2490048	Environmental → Ground → Unknown	EF 3.1	kg	4
fe0acd60-3ddc-11dd-ae8d-0050c2490048	Environmental → Water → Long-term	EF 3.1	kg	0
fe0acd60-3ddc-11dd-ae90-0050c2490048	Environmental → Water → Ocean	EF 3.1	kg	4
fe0acd60-3ddc-11dd-ae8c-0050c2490048	Environmental → Water → Surface water	EF 3.1	kg	4
7aa36368061d68dc2af854a4d5ca8f387c5e1838	Environmental → Water → Unconfined aquifer	stepwise algorithm addition	kg	0
fe0acd60-3ddc-11dd-ae8e-0050c2490048	Environmental → Water → Unknown	EF 3.1	kg	4

Everything that changed this substance (57 changes)

Open the changes page

Flow object JSON

{
  "flow_object_id": "fo-7debe567b4376f16",
  "prefLabel": [
    {
      "@value": "Captafol",
      "@language": "en",
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  "altLabel": [
    {
      "@value": "(tetrachloroethylthio)tetrahydrophthalimide",
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        "prov:wasDerivedFrom": "chebi synonym match"
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    {
      "@value": "1,2,3,6-tetrahydro-N-(1,1,2,2-tetrachloroethylthio)phthalimide",
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        "prov:wasDerivedFrom": "chebi synonym match"
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    },
    {
      "@value": "1H-Isoindole-1,3(2H)-dione, 3a,4,7,7a-tetrahydro-2-[(1,1,2,2-tetrachloroethyl)thio]-",
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    {
      "@value": "2-[(1,1,2,2-tetrachloroethyl)sulfanyl]-3a,4,7,7a-tetrahydro-1H-isoindole-1,3(2H)-dione",
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      "@lang": "en",
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    {
      "@value": "3a,4,7,7a-tetrahydro-2-[(1,1,2,2-tetrachloroethyl)thio]-1H-isoindole-1,3(2H)-dione",
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    {
      "@value": "3a,4,7,7a-tetrahydro-N-(1,1,2,2-tetrachloroethanesulphenyl)phthalimide",
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    },
    {
      "@value": "4-Cyclohexene-1,2-dicarboximide, N-[(1,1,2,2-tetrachloroethyl)thio]-",
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    {
      "@value": "Arborseal",
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    {
      "@value": "Captaspor",
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      "@value": "Difolatan",
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    },
    {
      "@value": "Difolatan 4F",
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    },
    {
      "@value": "Difolatan 4F1",
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    },
    {
      "@value": "Difolatan 80W",
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    },
    {
      "@value": "Difolatan BOW",
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    },
    {
      "@value": "Difosan",
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    },
    {
      "@value": "Folcid",
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    },
    {
      "@value": "Foltaf",
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    },
    {
      "@value": "Haipen",
      "@language": "en",
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    },
    {
      "@value": "Haipen 50",
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      "provenance": {
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        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Kenofol",
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    },
    {
      "@value": "Merpafol",
      "@language": "en",
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        "prov:wasDerivedFrom": "chebi synonym match"
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    },
    {
      "@value": "N-(1,1,2,2-Tetrachloroethylthio)-4-cyclohexene-1,2-dicarboximide",
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    },
    {
      "@value": "N-(1,1,2,2-Tetrachloroethylthio)-4-cyclohexene-1,2-dicarboxyimide",
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      }
    },
    {
      "@value": "N-(1,1,2,2-tetrachloroethylthio)-Delta(4)-tetrahydrophthalimide",
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      "@lang": "en",
      "provenance": {
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      }
    },
    {
      "@value": "N-(1,1,2,2-Tetrachloroethylthio)-Δ4-tetrahydrophthalimide",
      "@language": "en",
      "@lang": "en",
      "provenance": {
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        ],
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      }
    },
    {
      "@value": "N-(Tetrachloroethylthio)tetrahydrophthalimide",
      "@language": "en",
      "@lang": "en",
      "provenance": {
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        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "N-1,1,2,2-tetrachloroethylmercapto-4-cyclohexene-1,2-carboximide",
      "@language": "en",
      "@lang": "en",
      "provenance": {
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          "http://purl.obolibrary.org/obo/CHEBI_81938"
        ],
        "prov:wasDerivedFrom": "chebi synonym match"
      }
    },
    {
      "@value": "N-1,1,2,2-Tetrachloroethylmercapto-4-cyclohexene-1,2-dicarboximide",
      "@language": "en",
      "@lang": "en",
      "provenance": {
        "prov:wasGeneratedBy": "consensus_match",
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        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "N-[(1,1,2,2-tetrachloroethyl)sulfenyl]-4-cyclohexene-1,2-dicarboximide",
      "@language": "en",
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      "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": [
        "219-363-3"
      ],
      "rdfs:seeAlso": [
        "https://echa.europa.eu/search-for-chemicals?query=219-363-3"
      ],
      "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 dicarboximide that captan in which the trichloromethyl group is replaced by a 1,1,2,2-tetrachloroethyl group. A broad-spectrum fungicide used to control diseases in fruit and potatoes, it is no longer approved for use in the European Community.",
      "@language": "en",
      "provenance": {
        "prov:wasGeneratedBy": "enrich_references.chebi_definition",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "http://purl.obolibrary.org/obo/CHEBI_81938"
        ],
        "prov:wasDerivedFrom": "chebi.definition"
      }
    }
  ],
  "@type": [
    "https://w3id.org/chemrof/NeutralMolecule"
  ],
  "http://purl.obolibrary.org/obo/RO_0000087": [
    {
      "@id": "http://purl.obolibrary.org/obo/CHEBI_33286",
      "rdfs:label": "agrochemical",
      "http://www.w3.org/2004/02/skos/core#definition": "An agrochemical is a substance that is used in agriculture or horticulture.",
      "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_24127",
      "rdfs:label": "fungicide",
      "http://www.w3.org/2004/02/skos/core#definition": "A substance used to destroy fungal 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"
      }
    }
  ]
}

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

Captafol

Identity

Structure

What it is used for

Alternative labels

Properties

Known URLs

Elementary flows

History

Full record

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