2,3,5-trichlorophenol

← Back to consensus flows

UUID bca6a697-fcdd-402d-b338-43b536c0decf

Deprecated yes

Replaced By fb80e299-350d-4ea8-a748-2819d6251729

Flow Object ID fo-2157d1ac1de610ac

Source EF 3.1

Context Environmental → Water → Unknown

CAS Numbers 933-78-8

EC Numbers 213-272-2

prefLabel

Language	Value	Provenance
`en`	`2,3,5-trichlorophenol`

altLabel ⓘ

Language	Value	Provenance
`en`	`Phenol, 2,3,5-trichloro-`

References

Shared Properties

Predicate	Value
InChIKey	`VRNADRCOROWLJC-UHFFFAOYSA-N, WWGQHTJIFOQAOC-UHFFFAOYSA-N`
InChI	`InChI=1S/C6H3Cl3O/c7-3-1-4(8)6(9)5(10)2-3/h1-2,10H, InChI=1S/C8H5ClO3/c9-6-2-8-7(11-4-12-8)1-5(6)3-10/h1-3H,4H2`
IUPAC name	`2,3,5-trichlorophenol, 2,3,5-tris(chloranyl)phenol, 6-chloranyl-1,3-benzodioxole-5-carbaldehyde, 6-chloro-1,3-benzodioxole-5-carbaldehyde, 6-chloro-1,3-benzodioxole-5-carboxaldehyde, 6-chloropiperonal`
Molecular formula	`C6H3Cl3O, C8H5ClO3`
SMILES	`C1=C(C=C(C(=C1O)Cl)Cl)Cl, C1OC2=C(O1)C=C(C(=C2)C=O)Cl`

Source List References

List	Version	Source Flow UUID	Source Flow Name
EF	3.1	`bca6a697-fcdd-402d-b338-43b536c0decf`	2,3,5-trichlorophenol

Consolidated Field Provenance

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

Field	Change Count	Latest Time	Transformers	Latest Comment
`altLabel`	1	`—`	consensus_match	group_key=2,3,5-trichlorophenol\|\|dimension=Environmental > media=Air > strata=Aircraft cruise height; cas=933-78-8; added Common Chemistry CAS names as altLabel: Phenol, 2,3,5-trichloro-; object_uuid=fo-2157d1ac1de610ac
`cas_match_labels`	1	`—`	consensus_match	group_key=2,3,5-trichlorophenol\|\|dimension=Environmental > media=Air > strata=Aircraft cruise height; group_sources=['ec_inventory', 'pubchem']; cas_sources={'933-78-8': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-2157d1ac1de610ac: {'933-78-8': 'exactMatch'}

Context Attributes

Attribute	Value
dimension	Environmental
media	Water
water_body	Unknown

Consensus Changes

Field	Old Value	New Value	Comment
`altLabel`	`None`	`[{'@value': 'Phenol, 2,3,5-trichloro-', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:933-78-8', 'https://commonchemistry.cas.org/detail?cas_rn=933-78-8'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}]`	group_key=2,3,5-trichlorophenol\|\|dimension=Environmental > media=Air > strata=Aircraft cruise height; cas=933-78-8; added Common Chemistry CAS names as altLabel: Phenol, 2,3,5-trichloro-; object_uuid=fo-2157d1ac1de610ac
`cas_match_labels`	`None`	`{'933-78-8': 'exactMatch'}`	group_key=2,3,5-trichlorophenol\|\|dimension=Environmental > media=Air > strata=Aircraft cruise height; group_sources=['ec_inventory', 'pubchem']; cas_sources={'933-78-8': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-2157d1ac1de610ac: {'933-78-8': 'exactMatch'}

PROV-O Consensus Activity Trail

No PROV-O consensus activities found for this flow.

Full Flow JSON

{
  "uuid": "bca6a697-fcdd-402d-b338-43b536c0decf",
  "name": null,
  "cas_numbers": [
    "933-78-8"
  ],
  "ec_numbers": [
    "213-272-2"
  ],
  "context": {
    "dimension": "Environmental",
    "media": "Water",
    "water_body": "Unknown"
  },
  "general_comment": null,
  "synonyms": [],
  "unit": "kg",
  "lcia_methods": [],
  "source": "EF 3.1",
  "identifier": "bca6a697-fcdd-402d-b338-43b536c0decf",
  "input_datasets": [
    "EF 3.1"
  ],
  "source_refs": [
    {
      "list_name": "EF",
      "list_version": "3.1",
      "source_flow_uuid": "bca6a697-fcdd-402d-b338-43b536c0decf",
      "source_flow_name": "2,3,5-trichlorophenol",
      "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 water",
          "Emissions to water, unspecified (long-term)"
        ]
      }
    }
  ],
  "prefLabel": [
    {
      "@value": "2,3,5-trichlorophenol",
      "@language": "en",
      "source": {
        "prov:wasGeneratedBy": "bootstrap_labels",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "EF 3.1"
        ],
        "prov:wasDerivedFrom": "legacy name field"
      }
    }
  ],
  "_sources": {
    "prefLabel": "bootstrap_labels",
    "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",
    "altLabel": "consensus_match",
    "cas_match_labels": "consensus_match"
  },
  "context_iri": "https://vocab.brightway.one/flow-contexts/envi-wate-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": [
        "C6H3Cl3O",
        "C8H5ClO3"
      ],
      "rdfs:label": "Molecular formula",
      "provenance": {
        "prov:wasGeneratedBy": "enrich_references.pubchem_semantic",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CID:13619",
          "CID:140014"
        ],
        "prov:wasDerivedFrom": "pubchem.props.Molecular Formula"
      }
    },
    "https://w3id.org/chemrof/inchi2d_key_string": {
      "@id": "https://w3id.org/chemrof/inchi2d_key_string",
      "@value": [
        "VRNADRCOROWLJC-UHFFFAOYSA-N",
        "WWGQHTJIFOQAOC-UHFFFAOYSA-N"
      ],
      "rdfs:label": "InChIKey",
      "provenance": {
        "prov:wasGeneratedBy": "enrich_references.pubchem_semantic",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CID:13619",
          "CID:140014"
        ],
        "prov:wasDerivedFrom": "pubchem.props.InChIKey"
      }
    },
    "https://w3id.org/chemrof/smiles_string": {
      "@id": "https://w3id.org/chemrof/smiles_string",
      "@value": [
        "C1=C(C=C(C(=C1O)Cl)Cl)Cl",
        "C1OC2=C(O1)C=C(C(=C2)C=O)Cl"
      ],
      "rdfs:label": "SMILES",
      "provenance": {
        "prov:wasGeneratedBy": "enrich_references.pubchem_semantic",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CID:13619",
          "CID:140014"
        ],
        "prov:wasDerivedFrom": "pubchem.props.SMILES"
      }
    },
    "https://w3id.org/chemrof/inchi2d_string": {
      "@id": "https://w3id.org/chemrof/inchi2d_string",
      "@value": [
        "InChI=1S/C6H3Cl3O/c7-3-1-4(8)6(9)5(10)2-3/h1-2,10H",
        "InChI=1S/C8H5ClO3/c9-6-2-8-7(11-4-12-8)1-5(6)3-10/h1-3H,4H2"
      ],
      "rdfs:label": "InChI",
      "provenance": {
        "prov:wasGeneratedBy": "enrich_references.pubchem_semantic",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CID:13619",
          "CID:140014"
        ],
        "prov:wasDerivedFrom": "pubchem.props.InChI"
      }
    },
    "https://w3id.org/chemrof/IUPAC_name": {
      "@id": "https://w3id.org/chemrof/IUPAC_name",
      "@value": [
        "2,3,5-trichlorophenol",
        "2,3,5-tris(chloranyl)phenol",
        "6-chloranyl-1,3-benzodioxole-5-carbaldehyde",
        "6-chloro-1,3-benzodioxole-5-carbaldehyde",
        "6-chloro-1,3-benzodioxole-5-carboxaldehyde",
        "6-chloropiperonal"
      ],
      "rdfs:label": "IUPAC name",
      "provenance": {
        "prov:wasGeneratedBy": "enrich_references.pubchem_semantic",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CID:13619",
          "CID:140014"
        ],
        "prov:wasDerivedFrom": "pubchem.identifiers.IUPAC Name"
      }
    }
  },
  "skos:definition": [],
  "references": [
    {
      "@id": "http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J1.750G",
      "provenance": {
        "prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CID:13619;CAS:933-78-8"
        ],
        "prov:wasDerivedFrom": "pubchem.identifiers[933-78-8]"
      }
    },
    {
      "@id": "http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J266.803C",
      "provenance": {
        "prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CID:140014;CAS:933-78-8"
        ],
        "prov:wasDerivedFrom": "pubchem.identifiers[933-78-8]"
      }
    },
    {
      "@id": "https://chem.echa.europa.eu/100.012.066",
      "provenance": {
        "prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CID:13619;CAS:933-78-8"
        ],
        "prov:wasDerivedFrom": "pubchem.identifiers[933-78-8]"
      }
    },
    {
      "@id": "https://chem.echa.europa.eu/100.206.612",
      "provenance": {
        "prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CID:140014;CAS:933-78-8"
        ],
        "prov:wasDerivedFrom": "pubchem.identifiers[933-78-8]"
      }
    },
    {
      "@id": "https://chemicalsafety.ilo.org/dyn/icsc/showcard.display?p_card_id=0589",
      "provenance": {
        "prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CID:13619;CAS:933-78-8"
        ],
        "prov:wasDerivedFrom": "pubchem.identifiers[933-78-8]"
      }
    },
    {
      "@id": "https://commonchemistry.cas.org/detail?cas_rn=933-78-8",
      "provenance": {
        "prov:wasGeneratedBy": "enrich_references.consensus_cas_link",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "933-78-8"
        ],
        "prov:wasDerivedFrom": "cas_numbers"
      }
    },
    {
      "@id": "https://comptox.epa.gov/dashboard/DTXSID0026208",
      "provenance": {
        "prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CID:13619;CAS:933-78-8"
        ],
        "prov:wasDerivedFrom": "pubchem.identifiers[933-78-8]"
      }
    },
    {
      "@id": "https://comptox.epa.gov/dashboard/DTXSID40166674",
      "provenance": {
        "prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CID:140014;CAS:933-78-8"
        ],
        "prov:wasDerivedFrom": "pubchem.identifiers[933-78-8]"
      }
    },
    {
      "@id": "https://dtp.cancer.gov/dtpstandard/servlet/dwindex?searchtype=NSC&outputformat=html&searchlist=166400",
      "provenance": {
        "prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CID:140014;CAS:933-78-8"
        ],
        "prov:wasDerivedFrom": "pubchem.identifiers[933-78-8]"
      }
    },
    {
      "@id": "https://gsrs.ncats.nih.gov/ginas/app/beta/substances/6T7DUC2C8B",
      "provenance": {
        "prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CID:13619;CAS:933-78-8"
        ],
        "prov:wasDerivedFrom": "pubchem.identifiers[933-78-8]"
      }
    },
    {
      "@id": "https://gsrs.ncats.nih.gov/ginas/app/beta/substances/FLN3X72UKA",
      "provenance": {
        "prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CID:140014;CAS:933-78-8"
        ],
        "prov:wasDerivedFrom": "pubchem.identifiers[933-78-8]"
      }
    },
    {
      "@id": "https://pubchem.ncbi.nlm.nih.gov/compound/13619",
      "provenance": {
        "prov:wasGeneratedBy": "enrich_references.pubchem_compound",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CID:13619;CAS:933-78-8"
        ],
        "prov:wasDerivedFrom": "pubchem.by_cas[933-78-8]"
      }
    },
    {
      "@id": "https://pubchem.ncbi.nlm.nih.gov/compound/140014",
      "provenance": {
        "prov:wasGeneratedBy": "enrich_references.pubchem_compound",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CID:140014;CAS:933-78-8"
        ],
        "prov:wasDerivedFrom": "pubchem.by_cas[933-78-8]"
      }
    },
    {
      "@id": "https://pubchem.ncbi.nlm.nih.gov/erg/#2020",
      "provenance": {
        "prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CID:13619;CAS:933-78-8"
        ],
        "prov:wasDerivedFrom": "pubchem.identifiers[933-78-8]"
      }
    },
    {
      "@id": "https://www.ebi.ac.uk/chembl/explore/compound/CHEMBL1569358",
      "provenance": {
        "prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CID:13619;CAS:933-78-8"
        ],
        "prov:wasDerivedFrom": "pubchem.identifiers[933-78-8]"
      }
    },
    {
      "@id": "https://www.metabolomicsworkbench.org/data/StructureData.php?RegNo=143645",
      "provenance": {
        "prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CID:13619;CAS:933-78-8"
        ],
        "prov:wasDerivedFrom": "pubchem.identifiers[933-78-8]"
      }
    },
    {
      "@id": "https://www.wikidata.org/wiki/Q2682869",
      "provenance": {
        "prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CID:13619;CAS:933-78-8"
        ],
        "prov:wasDerivedFrom": "pubchem.identifiers[933-78-8]"
      }
    },
    {
      "@id": "https://www.wikidata.org/wiki/Q83035882",
      "provenance": {
        "prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CID:140014;CAS:933-78-8"
        ],
        "prov:wasDerivedFrom": "pubchem.identifiers[933-78-8]"
      }
    }
  ],
  "altLabel": [
    {
      "@value": "Phenol, 2,3,5-trichloro-",
      "@language": "en",
      "source": {
        "prov:wasGeneratedBy": "consensus_match",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CAS:933-78-8",
          "https://commonchemistry.cas.org/detail?cas_rn=933-78-8"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    }
  ],
  "cas_match_labels": {
    "933-78-8": "exactMatch"
  },
  "http://www.w3.org/2002/07/owl#deprecated": true,
  "http://purl.org/dc/terms/isReplacedBy": "urn:uuid:fb80e299-350d-4ea8-a748-2819d6251729",
  "is_replaced_by_uuid": "fb80e299-350d-4ea8-a748-2819d6251729",
  "flow_object_id": "fo-2157d1ac1de610ac"
}