← Back to consensus flow objects

3,4,5-Trichloro-2,6-dimethoxyphenol

Flow Object IDfo-5f4dcf659139ffac
TypeConsensus
prefLabel
Label Language
3,4,5-Trichloro-2,6-dimethoxyphenol en
3,4,5-tricl-2,6-meo Phenol en
CAS Numbers2539-26-6
Changes Applied13

Properties

Predicate Value
InChIKey ZZCSBXFJFLSDRR-UHFFFAOYSA-N
InChI InChI=1S/C8H7Cl3O3/c1-13-7-4(10)3(9)5(11)8(14-2)6(7)12/h12H,1-2H3
IUPAC name 3,4,5-trichloro-2,6-dimethoxy-phenol, 3,4,5-trichloro-2,6-dimethoxyphenol, 3,4,5-tris(chloranyl)-2,6-dimethoxy-phenol
Molecular formula C8H7Cl3O3
SMILES COC1=C(C(=C(C(=C1Cl)Cl)Cl)OC)O

References

Linked Elementary Flows

UUID Source Unit Context LCIA Factors Consensus Changes
a23fdeb9… EF 3.1 kg Environmental → Air → Aircraft cruise height 2 1
e81c386b… EF 3.1 kg Environmental → Air → Ground level → Rural (<1000 people/square mile) 0 1
47c2bf19… EF 3.1 kg Environmental → Air → Ground level → Urban (>1000 people/square mile) 2 1
4cded3f4… EF 3.1 kg Environmental → Air → High stack, >150 meters 2 1
55512d14… EF 3.1 kg Environmental → Air → Unknown 2 1
cc83284a… EF 3.1 kg Environmental → Air → Unknown 2 1
bda3f26f… EF 3.1 kg Environmental → Ground → Agricultural 2 1
292e1051… EF 3.1 kg Environmental → Ground → Unknown 2 1
d8083919… EF 3.1 kg Environmental → Water → Ocean 2 1
afd8a3ea… EF 3.1 kg Environmental → Water → Surface water 2 1
2e80df66… EF 3.1 kg Environmental → Water → Unknown 2 1
▶

Changes Applied
Elementary Flow Field Old Value New Value Comment
1d837682… cas_match_labels — {"2539-26-6":"exactMatch"} group_key=3,4,5-trichloro-2,6-dimethoxyphenol||dimension=Environmental > media=Water > water_body=Unknown; group_sources=['pubchem']; cas_sources={'2539-26-6': ['pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-5f4dcf659139ffac: {'2539-26-6': 'exactMatch'}
292e1051… cas_match_labels — {"2539-26-6":"exactMatch"} group_key=3,4,5-trichloro-2,6-dimethoxyphenol||dimension=Environmental > media=Water > water_body=Unknown; group_sources=['pubchem']; cas_sources={'2539-26-6': ['pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-5f4dcf659139ffac: {'2539-26-6': 'exactMatch'}
2e80df66… cas_match_labels — {"2539-26-6":"exactMatch"} group_key=3,4,5-trichloro-2,6-dimethoxyphenol||dimension=Environmental > media=Water > water_body=Unknown; group_sources=['pubchem']; cas_sources={'2539-26-6': ['pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-5f4dcf659139ffac: {'2539-26-6': 'exactMatch'}
47c2bf19… cas_match_labels — {"2539-26-6":"exactMatch"} group_key=3,4,5-trichloro-2,6-dimethoxyphenol||dimension=Environmental > media=Water > water_body=Unknown; group_sources=['pubchem']; cas_sources={'2539-26-6': ['pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-5f4dcf659139ffac: {'2539-26-6': 'exactMatch'}
4cded3f4… cas_match_labels — {"2539-26-6":"exactMatch"} group_key=3,4,5-trichloro-2,6-dimethoxyphenol||dimension=Environmental > media=Water > water_body=Unknown; group_sources=['pubchem']; cas_sources={'2539-26-6': ['pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-5f4dcf659139ffac: {'2539-26-6': 'exactMatch'}
55512d14… cas_match_labels — {"2539-26-6":"exactMatch"} group_key=3,4,5-trichloro-2,6-dimethoxyphenol||dimension=Environmental > media=Water > water_body=Unknown; group_sources=['pubchem']; cas_sources={'2539-26-6': ['pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-5f4dcf659139ffac: {'2539-26-6': 'exactMatch'}
88acaf16… cas_match_labels — {"2539-26-6":"exactMatch"} group_key=3,4,5-trichloro-2,6-dimethoxyphenol||dimension=Environmental > media=Water > water_body=Unknown; group_sources=['pubchem']; cas_sources={'2539-26-6': ['pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-5f4dcf659139ffac: {'2539-26-6': 'exactMatch'}
a23fdeb9… cas_match_labels — {"2539-26-6":"exactMatch"} group_key=3,4,5-trichloro-2,6-dimethoxyphenol||dimension=Environmental > media=Water > water_body=Unknown; group_sources=['pubchem']; cas_sources={'2539-26-6': ['pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-5f4dcf659139ffac: {'2539-26-6': 'exactMatch'}
afd8a3ea… cas_match_labels — {"2539-26-6":"exactMatch"} group_key=3,4,5-trichloro-2,6-dimethoxyphenol||dimension=Environmental > media=Water > water_body=Unknown; group_sources=['pubchem']; cas_sources={'2539-26-6': ['pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-5f4dcf659139ffac: {'2539-26-6': 'exactMatch'}
bda3f26f… cas_match_labels — {"2539-26-6":"exactMatch"} group_key=3,4,5-trichloro-2,6-dimethoxyphenol||dimension=Environmental > media=Water > water_body=Unknown; group_sources=['pubchem']; cas_sources={'2539-26-6': ['pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-5f4dcf659139ffac: {'2539-26-6': 'exactMatch'}
cc83284a… cas_match_labels — {"2539-26-6":"exactMatch"} group_key=3,4,5-trichloro-2,6-dimethoxyphenol||dimension=Environmental > media=Water > water_body=Unknown; group_sources=['pubchem']; cas_sources={'2539-26-6': ['pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-5f4dcf659139ffac: {'2539-26-6': 'exactMatch'}
d8083919… cas_match_labels — {"2539-26-6":"exactMatch"} group_key=3,4,5-trichloro-2,6-dimethoxyphenol||dimension=Environmental > media=Water > water_body=Unknown; group_sources=['pubchem']; cas_sources={'2539-26-6': ['pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-5f4dcf659139ffac: {'2539-26-6': 'exactMatch'}
e81c386b… cas_match_labels — {"2539-26-6":"exactMatch"} group_key=3,4,5-trichloro-2,6-dimethoxyphenol||dimension=Environmental > media=Water > water_body=Unknown; group_sources=['pubchem']; cas_sources={'2539-26-6': ['pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-5f4dcf659139ffac: {'2539-26-6': 'exactMatch'}

Flow Object JSON

{
  "flow_object_id": "fo-5f4dcf659139ffac",
  "prefLabel": [
    {
      "@value": "3,4,5-Trichloro-2,6-dimethoxyphenol",
      "@language": "en",
      "@lang": "en",
      "provenance": {
        "prov:wasGeneratedBy": "hybrid_name_cas_v1",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "EF 3.1"
        ],
        "prov:wasDerivedFrom": "prefLabel"
      }
    },
    {
      "@value": "3,4,5-tricl-2,6-meo Phenol",
      "@language": "en",
      "@lang": "en",
      "provenance": {
        "prov:wasGeneratedBy": "hybrid_name_cas_v1",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "EF 3.1"
        ],
        "prov:wasDerivedFrom": "prefLabel"
      }
    }
  ],
  "altLabel": [],
  "properties": {
    "https://w3id.org/chemrof/molecular_formula": {
      "@id": "https://w3id.org/chemrof/molecular_formula",
      "@value": [
        "C8H7Cl3O3"
      ],
      "rdfs:label": "Molecular formula",
      "provenance": {
        "prov:wasGeneratedBy": "enrich_references.pubchem_semantic",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CID:17344"
        ],
        "prov:wasDerivedFrom": "pubchem.props.Molecular Formula"
      }
    },
    "https://w3id.org/chemrof/inchi2d_key_string": {
      "@id": "https://w3id.org/chemrof/inchi2d_key_string",
      "@value": [
        "ZZCSBXFJFLSDRR-UHFFFAOYSA-N"
      ],
      "rdfs:label": "InChIKey",
      "provenance": {
        "prov:wasGeneratedBy": "enrich_references.pubchem_semantic",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CID:17344"
        ],
        "prov:wasDerivedFrom": "pubchem.props.InChIKey"
      }
    },
    "https://w3id.org/chemrof/smiles_string": {
      "@id": "https://w3id.org/chemrof/smiles_string",
      "@value": [
        "COC1=C(C(=C(C(=C1Cl)Cl)Cl)OC)O"
      ],
      "rdfs:label": "SMILES",
      "provenance": {
        "prov:wasGeneratedBy": "enrich_references.pubchem_semantic",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CID:17344"
        ],
        "prov:wasDerivedFrom": "pubchem.props.SMILES"
      }
    },
    "https://w3id.org/chemrof/inchi2d_string": {
      "@id": "https://w3id.org/chemrof/inchi2d_string",
      "@value": [
        "InChI=1S/C8H7Cl3O3/c1-13-7-4(10)3(9)5(11)8(14-2)6(7)12/h12H,1-2H3"
      ],
      "rdfs:label": "InChI",
      "provenance": {
        "prov:wasGeneratedBy": "enrich_references.pubchem_semantic",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CID:17344"
        ],
        "prov:wasDerivedFrom": "pubchem.props.InChI"
      }
    },
    "https://w3id.org/chemrof/IUPAC_name": {
      "@id": "https://w3id.org/chemrof/IUPAC_name",
      "@value": [
        "3,4,5-trichloro-2,6-dimethoxy-phenol",
        "3,4,5-trichloro-2,6-dimethoxyphenol",
        "3,4,5-tris(chloranyl)-2,6-dimethoxy-phenol"
      ],
      "rdfs:label": "IUPAC name",
      "provenance": {
        "prov:wasGeneratedBy": "enrich_references.pubchem_semantic",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CID:17344"
        ],
        "prov:wasDerivedFrom": "pubchem.identifiers.IUPAC Name"
      }
    }
  },
  "references": [
    {
      "@id": "http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J569.094C",
      "provenance": {
        "prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CID:17344;CAS:2539-26-6"
        ],
        "prov:wasDerivedFrom": "pubchem.identifiers[2539-26-6]"
      }
    },
    {
      "@id": "https://commonchemistry.cas.org/detail?cas_rn=2539-26-6",
      "provenance": {
        "prov:wasGeneratedBy": "enrich_references.consensus_cas_link",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "2539-26-6"
        ],
        "prov:wasDerivedFrom": "cas_numbers"
      }
    },
    {
      "@id": "https://comptox.epa.gov/dashboard/DTXSID7074246",
      "provenance": {
        "prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CID:17344;CAS:2539-26-6"
        ],
        "prov:wasDerivedFrom": "pubchem.identifiers[2539-26-6]"
      }
    },
    {
      "@id": "https://pubchem.ncbi.nlm.nih.gov/compound/17344",
      "provenance": {
        "prov:wasGeneratedBy": "enrich_references.pubchem_compound",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CID:17344;CAS:2539-26-6"
        ],
        "prov:wasDerivedFrom": "pubchem.by_cas[2539-26-6]"
      }
    },
    {
      "@id": "https://www.wikidata.org/wiki/Q82002654",
      "provenance": {
        "prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CID:17344;CAS:2539-26-6"
        ],
        "prov:wasDerivedFrom": "pubchem.identifiers[2539-26-6]"
      }
    }
  ],
  "created_from": {
    "resolver": "hybrid_name_cas_v1",
    "seed_uuid": "1d837682-2d6e-4d4e-a759-a397f740e583",
    "seed_source": "EF 3.1"
  },
  "classifications": {
    "http://semanticscience.org/resource/CHEMINF_000446": {
      "@value": [
        "2539-26-6"
      ],
      "rdfs:seeAlso": [
        "https://commonchemistry.cas.org/detail?cas_rn=2539-26-6"
      ],
      "skos:exactMatch": [
        {
          "@id": "https://commonchemistry.cas.org/detail?cas_rn=2539-26-6"
        }
      ],
      "provenance": {
        "prov:wasGeneratedBy": "hybrid_name_cas_v1",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "EF 3.1"
        ],
        "prov:wasDerivedFrom": "cas_numbers"
      }
    }
  },
  "origin_qualifier": null,
  "parent_flow_object_id": null
}