2,4-dichlorodiphenyl Ether

← Back to consensus flows

2,4-dichlorodiphenyl Ether

UUID 0f3235d5-4fa2-42bf-b21d-3ae414029e57

Deprecated yes

Replaced By 067ef639-4b0d-4aa8-ac48-106d97118763

Flow Object ID fo-91f6cdff6b15f1ca

Source EF 3.1

Context Environmental → Ground → Unknown

CAS Numbers 51892-26-3

prefLabel

Language	Value	Provenance
`en`	`2,4-dichlorodiphenyl Ether`

References

Shared Properties

Predicate	Value
InChIKey	`FTCYIGBVOHNHCD-UHFFFAOYSA-N, KXIPYLZZJZMMPD-UHFFFAOYSA-N`
InChI	`InChI=1S/C12H8Cl2O/c13-9-6-7-12(11(14)8-9)15-10-4-2-1-3-5-10/h1-8H, InChI=1S/C7H11N3/c1-6(2)10-7-8-4-3-5-9-7/h3-6H,1-2H3,(H,8,9,10)`
IUPAC name	`2,4-bis(chloranyl)-1-phenoxy-benzene, 2,4-dichloro-1-phenoxy-benzene, 2,4-dichloro-1-phenoxybenzene, N-isopropylpyrimidin-2-amine, N-propan-2-yl-2-pyrimidinamine, N-propan-2-ylpyrimidin-2-amine, isopropyl(2-pyrimidyl)amine`
Molecular formula	`C12H8Cl2O, C7H11N3`
SMILES	`C1=CC=C(C=C1)OC2=C(C=C(C=C2)Cl)Cl, CC(C)NC1=NC=CC=N1`

Source List References

List	Version	Source Flow UUID	Source Flow Name
EF	3.1	`0f3235d5-4fa2-42bf-b21d-3ae414029e57`	2,4-dichlorodiphenyl ether

Consolidated Field Provenance

0 total PROV activity record(s) for this flow.

Field	Change Count	Latest Time	Transformers	Latest Comment
`cas_match_labels`	1	`—`	consensus_match	group_key=2,4-dichlorodiphenylether\|\|dimension=Environmental > media=Water > water_body=Ocean; group_sources=['pubchem']; cas_sources={'51892-26-3': ['pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-91f6cdff6b15f1ca: {'51892-26-3': 'exactMatch'}

Context Attributes

Attribute	Value
dimension	Environmental
media	Ground
geography	Unknown

Consensus Changes

Field	Old Value	New Value	Comment
`cas_match_labels`	`None`	`{'51892-26-3': 'exactMatch'}`	group_key=2,4-dichlorodiphenylether\|\|dimension=Environmental > media=Water > water_body=Ocean; group_sources=['pubchem']; cas_sources={'51892-26-3': ['pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-91f6cdff6b15f1ca: {'51892-26-3': 'exactMatch'}

PROV-O Consensus Activity Trail

No PROV-O consensus activities found for this flow.

Full Flow JSON

{
  "uuid": "0f3235d5-4fa2-42bf-b21d-3ae414029e57",
  "name": null,
  "cas_numbers": [
    "51892-26-3"
  ],
  "ec_numbers": [],
  "context": {
    "dimension": "Environmental",
    "media": "Ground",
    "geography": "Unknown"
  },
  "general_comment": "Correct mapping CAS and flow to be verfied, though probably correct. Reference elementary flow of the International Reference Life Cycle Data System (ILCD).",
  "synonyms": [],
  "unit": "kg",
  "lcia_methods": [
    {
      "method_uuid": "05316e7a-b254-4bea-9cf0-6bf33eb5c630",
      "name": "Ecotoxicity, freshwater",
      "methodology": "Environmental Footprint",
      "impact_category": "Aquatic eco-toxicity",
      "impact_indicator": "Comparative Toxic Unit for ecosystems (CTUe) ",
      "characterization_factor": 143.16
    },
    {
      "method_uuid": "fd530f00-9325-424a-92ef-aaac67922fd9",
      "name": "Ecotoxicity, freshwater_organics",
      "methodology": "Environmental Footprint",
      "impact_category": "Aquatic eco-toxicity",
      "impact_indicator": "Comparative Toxic Unit for ecosystems (CTUe) ",
      "characterization_factor": 143.16
    }
  ],
  "source": "EF 3.1",
  "identifier": "0f3235d5-4fa2-42bf-b21d-3ae414029e57",
  "input_datasets": [
    "EF 3.1"
  ],
  "source_refs": [
    {
      "list_name": "EF",
      "list_version": "3.1",
      "source_flow_uuid": "0f3235d5-4fa2-42bf-b21d-3ae414029e57",
      "source_flow_name": "2,4-dichlorodiphenyl ether",
      "source_metadata": {
        "input_file": "/home/cmutel/.local/share/consensus-flow-list/ef-31-flows.json",
        "input_dataset": "EF 3.1",
        "original_context": [
          "Emissions",
          "Emissions to soil",
          "Emissions to non-agricultural soil"
        ]
      }
    }
  ],
  "prefLabel": [
    {
      "@value": "2,4-dichlorodiphenyl Ether",
      "@language": "en",
      "source": {
        "prov:wasGeneratedBy": "bootstrap_labels",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "EF 3.1"
        ],
        "prov:wasDerivedFrom": "legacy name field"
      }
    }
  ],
  "_sources": {
    "prefLabel": "normalize_name_case",
    "name": "bootstrap_labels",
    "synonyms": "bootstrap_labels",
    "context": "default_context_mapping",
    "context_iri": "default_context_mapping",
    "unit_iri": "unit_normalization",
    "properties": "enrich_references",
    "skos:definition": "enrich_references",
    "references": "enrich_references",
    "cas_match_labels": "consensus_match"
  },
  "context_iri": "https://vocab.brightway.one/flow-contexts/envi-grou-unkn",
  "unit_iri": "https://vocab.brightway.one/units/unit/KiloGM",
  "properties": {
    "https://w3id.org/chemrof/molecular_formula": {
      "@id": "https://w3id.org/chemrof/molecular_formula",
      "@value": [
        "C12H8Cl2O",
        "C7H11N3"
      ],
      "rdfs:label": "Molecular formula",
      "provenance": {
        "prov:wasGeneratedBy": "enrich_references.pubchem_semantic",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CID:71169",
          "CID:92339"
        ],
        "prov:wasDerivedFrom": "pubchem.props.Molecular Formula"
      }
    },
    "https://w3id.org/chemrof/inchi2d_key_string": {
      "@id": "https://w3id.org/chemrof/inchi2d_key_string",
      "@value": [
        "FTCYIGBVOHNHCD-UHFFFAOYSA-N",
        "KXIPYLZZJZMMPD-UHFFFAOYSA-N"
      ],
      "rdfs:label": "InChIKey",
      "provenance": {
        "prov:wasGeneratedBy": "enrich_references.pubchem_semantic",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CID:71169",
          "CID:92339"
        ],
        "prov:wasDerivedFrom": "pubchem.props.InChIKey"
      }
    },
    "https://w3id.org/chemrof/smiles_string": {
      "@id": "https://w3id.org/chemrof/smiles_string",
      "@value": [
        "C1=CC=C(C=C1)OC2=C(C=C(C=C2)Cl)Cl",
        "CC(C)NC1=NC=CC=N1"
      ],
      "rdfs:label": "SMILES",
      "provenance": {
        "prov:wasGeneratedBy": "enrich_references.pubchem_semantic",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CID:71169",
          "CID:92339"
        ],
        "prov:wasDerivedFrom": "pubchem.props.SMILES"
      }
    },
    "https://w3id.org/chemrof/inchi2d_string": {
      "@id": "https://w3id.org/chemrof/inchi2d_string",
      "@value": [
        "InChI=1S/C12H8Cl2O/c13-9-6-7-12(11(14)8-9)15-10-4-2-1-3-5-10/h1-8H",
        "InChI=1S/C7H11N3/c1-6(2)10-7-8-4-3-5-9-7/h3-6H,1-2H3,(H,8,9,10)"
      ],
      "rdfs:label": "InChI",
      "provenance": {
        "prov:wasGeneratedBy": "enrich_references.pubchem_semantic",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CID:71169",
          "CID:92339"
        ],
        "prov:wasDerivedFrom": "pubchem.props.InChI"
      }
    },
    "https://w3id.org/chemrof/IUPAC_name": {
      "@id": "https://w3id.org/chemrof/IUPAC_name",
      "@value": [
        "2,4-bis(chloranyl)-1-phenoxy-benzene",
        "2,4-dichloro-1-phenoxy-benzene",
        "2,4-dichloro-1-phenoxybenzene",
        "N-isopropylpyrimidin-2-amine",
        "N-propan-2-yl-2-pyrimidinamine",
        "N-propan-2-ylpyrimidin-2-amine",
        "isopropyl(2-pyrimidyl)amine"
      ],
      "rdfs:label": "IUPAC name",
      "provenance": {
        "prov:wasGeneratedBy": "enrich_references.pubchem_semantic",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CID:71169",
          "CID:92339"
        ],
        "prov:wasDerivedFrom": "pubchem.identifiers.IUPAC Name"
      }
    }
  },
  "skos:definition": [],
  "references": [
    {
      "@id": "http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J9.620B",
      "provenance": {
        "prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CID:71169;CAS:51892-26-3"
        ],
        "prov:wasDerivedFrom": "pubchem.identifiers[51892-26-3]"
      }
    },
    {
      "@id": "http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J99.852D",
      "provenance": {
        "prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CID:92339;CAS:51892-26-3"
        ],
        "prov:wasDerivedFrom": "pubchem.identifiers[51892-26-3]"
      }
    },
    {
      "@id": "https://commonchemistry.cas.org/detail?cas_rn=4214-72-6",
      "provenance": {
        "prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CID:71169;CAS:51892-26-3"
        ],
        "prov:wasDerivedFrom": "pubchem.identifiers[51892-26-3]"
      }
    },
    {
      "@id": "https://commonchemistry.cas.org/detail?cas_rn=51892-26-3",
      "provenance": {
        "prov:wasGeneratedBy": "enrich_references.consensus_cas_link",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "51892-26-3"
        ],
        "prov:wasDerivedFrom": "cas_numbers"
      }
    },
    {
      "@id": "https://comptox.epa.gov/dashboard/DTXSID00199847",
      "provenance": {
        "prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CID:92339;CAS:51892-26-3"
        ],
        "prov:wasDerivedFrom": "pubchem.identifiers[51892-26-3]"
      }
    },
    {
      "@id": "https://comptox.epa.gov/dashboard/DTXSID20194975",
      "provenance": {
        "prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CID:71169;CAS:51892-26-3"
        ],
        "prov:wasDerivedFrom": "pubchem.identifiers[51892-26-3]"
      }
    },
    {
      "@id": "https://drugcentral.org/drugcard/1485",
      "provenance": {
        "prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CID:71169;CAS:51892-26-3"
        ],
        "prov:wasDerivedFrom": "pubchem.identifiers[51892-26-3]"
      }
    },
    {
      "@id": "https://dtp.cancer.gov/dtpstandard/servlet/dwindex?searchtype=NSC&outputformat=html&searchlist=760406",
      "provenance": {
        "prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CID:71169;CAS:51892-26-3"
        ],
        "prov:wasDerivedFrom": "pubchem.identifiers[51892-26-3]"
      }
    },
    {
      "@id": "https://gsrs.ncats.nih.gov/ginas/app/beta/substances/49V3OO5743",
      "provenance": {
        "prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CID:92339;CAS:51892-26-3"
        ],
        "prov:wasDerivedFrom": "pubchem.identifiers[51892-26-3]"
      }
    },
    {
      "@id": "https://gsrs.ncats.nih.gov/ginas/app/beta/substances/883G6DMT63",
      "provenance": {
        "prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CID:71169;CAS:51892-26-3"
        ],
        "prov:wasDerivedFrom": "pubchem.identifiers[51892-26-3]"
      }
    },
    {
      "@id": "https://ncithesaurus.nci.nih.gov/ncitbrowser/ConceptReport.jsp?dictionary=NCI_Thesaurus&ns=ncit&code=C65969",
      "provenance": {
        "prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CID:71169;CAS:51892-26-3"
        ],
        "prov:wasDerivedFrom": "pubchem.identifiers[51892-26-3]"
      }
    },
    {
      "@id": "https://pubchem.ncbi.nlm.nih.gov/compound/71169",
      "provenance": {
        "prov:wasGeneratedBy": "enrich_references.pubchem_compound",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CID:71169;CAS:51892-26-3"
        ],
        "prov:wasDerivedFrom": "pubchem.by_cas[51892-26-3]"
      }
    },
    {
      "@id": "https://pubchem.ncbi.nlm.nih.gov/compound/92339",
      "provenance": {
        "prov:wasGeneratedBy": "enrich_references.pubchem_compound",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CID:92339;CAS:51892-26-3"
        ],
        "prov:wasDerivedFrom": "pubchem.by_cas[51892-26-3]"
      }
    },
    {
      "@id": "https://www.drugbank.ca/drugs/DB20311",
      "provenance": {
        "prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CID:71169;CAS:51892-26-3"
        ],
        "prov:wasDerivedFrom": "pubchem.identifiers[51892-26-3]"
      }
    },
    {
      "@id": "https://www.ebi.ac.uk/chebi/searchId.do?chebiId=CHEBI:134762",
      "provenance": {
        "prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CID:71169;CAS:51892-26-3"
        ],
        "prov:wasDerivedFrom": "pubchem.identifiers[51892-26-3]"
      }
    },
    {
      "@id": "https://www.ebi.ac.uk/chembl/explore/compound/CHEMBL1740513",
      "provenance": {
        "prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CID:71169;CAS:51892-26-3"
        ],
        "prov:wasDerivedFrom": "pubchem.identifiers[51892-26-3]"
      }
    },
    {
      "@id": "https://www.wikidata.org/wiki/Q27259310",
      "provenance": {
        "prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CID:92339;CAS:51892-26-3"
        ],
        "prov:wasDerivedFrom": "pubchem.identifiers[51892-26-3]"
      }
    },
    {
      "@id": "https://www.wikidata.org/wiki/Q27269878",
      "provenance": {
        "prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CID:71169;CAS:51892-26-3"
        ],
        "prov:wasDerivedFrom": "pubchem.identifiers[51892-26-3]"
      }
    }
  ],
  "cas_match_labels": {
    "51892-26-3": "exactMatch"
  },
  "http://www.w3.org/2002/07/owl#deprecated": true,
  "http://purl.org/dc/terms/isReplacedBy": "urn:uuid:067ef639-4b0d-4aa8-ac48-106d97118763",
  "is_replaced_by_uuid": "067ef639-4b0d-4aa8-ac48-106d97118763",
  "flow_object_id": "fo-91f6cdff6b15f1ca"
}