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Dacthal

UUID 4d9a8790-3ddd-11dd-9874-0050c2490048
Deprecated yes
Replaced By 4d9a8790-3ddd-11dd-9875-0050c2490048
Flow Object IDfo-8016443146f95296
Source EF 3.1
Context Environmental → Water → Unknown
CAS Numbers 1861-32-1
EC Numbers 217-464-7
prefLabel ⓘ
Language Value Provenance
en Dacthal
altLabel ⓘ
Language Value Provenance
en Chlorthal-dimethyl
en Dimethyl 2,3,5,6-tetrachloroterephthalate
en 1,4-Benzenedicarboxylic acid, 2,3,5,6-tetrachloro-, 1,4-dimethyl ester
en 1,4-Benzenedicarboxylic acid, 2,3,5,6-tetrachloro-, dimethyl ester
en 1,4-Dimethyl 2,3,5,6-tetrachlorobenzene-1,4-dicarboxylate
en 2,3,5,6-Tetrachloro-1,4-benzenedicarboxylic acid dimethyl ester
en Cepos
en Chlorthal dimethyl ester
en Chlorthal-methyl
en DAC 893
en DCPA
en DCPA (herbicide)
en Dac 4
en Dimethyl tetrachloroterephthalate
en NSC 155745
en TCTP
en Terephthalic acid, tetrachloro-, dimethyl ester
en Tetrachloroterephthalic acid dimethyl ester
en Tetral
References
Shared Properties
Predicate Value
Formal charge 0
InChIKey NPOJQCVWMSKXDN-UHFFFAOYSA-N
InChI InChI=1S/C10H6Cl4O4/c1-17-9(15)3-5(11)7(13)4(10(16)18-2)8(14)6(3)12/h1-2H3
IUPAC name 2,3,5,6-tetrachlorobenzene-1,4-dicarboxylic acid dimethyl ester, dimethyl 2,3,5,6-tetrachlorobenzene-1,4-dicarboxylate, dimethyl 2,3,5,6-tetrakis(chloranyl)benzene-1,4-dicarboxylate
Molecular formula C10H6Cl4O4
Molecular mass 331.966
Monoisotopic mass 329.90202
SMILES COC(=O)C1=C(C(=C(C(=C1Cl)Cl)C(=O)OC)Cl)Cl, COC(=O)c1c(Cl)c(Cl)c(C(=O)OC)c(Cl)c1Cl

Source List References

List Version Source Flow UUID Source Flow Name
EF 3.1 4d9a8790-3ddd-11dd-9874-0050c2490048 dimethyltetrachloroterephthalate

Consolidated Field Provenance

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

Field Change Count Latest Time Transformers Latest Comment
altLabel 2 — consensus_match group_key=dimethyltetrachloroterephthalate||dimension=Environmental > media=Air > strata=Aircraft cruise height; cas=1861-32-1; added Common Chemistry CAS names as altLabel: 1,4-Benzenedicarboxylic acid, 2,3,5,6-tetrachloro-, 1,4-dimethyl ester, 1,4-Benzenedicarboxylic acid, 2,3,5,6-tetrachloro-, dimethyl ester, 1,4-Dimethyl 2,3,5,6-tetrachlorobenzene-1,4-dicarboxylate, 2,3,5,6-Tetrachloro-1,4-benzenedicarboxylic acid dimethyl ester, Cepos, Chlorthal dimethyl ester, Chlorthal-methyl, DAC 893, DCPA, DCPA (herbicide), Dac 4, Dimethyl tetrachloroterephthalate, NSC 155745, TCTP, Terephthalic acid, tetrachloro-, dimethyl ester, Tetrachloroterephthalic acid dimethyl ester, Tetral; object_uuid=fo-8016443146f95296
cas_match_labels 1 — consensus_match group_key=dimethyltetrachloroterephthalate||dimension=Environmental > media=Air > strata=Aircraft cruise height; group_sources=['chebi', 'ec_inventory']; cas_sources={'1861-32-1': ['chebi', 'ec_inventory']}; assigned CAS labels from group consensus; object_uuid=fo-8016443146f95296: {'1861-32-1': 'exactMatch'}
prefLabel 1 — consensus_match cas=1861-32-1; cc_chebi_agreed_name='Dacthal'; object_uuid=fo-8016443146f95296

Context Attributes

AttributeValue
dimensionEnvironmental
mediaWater
water_bodyUnknown

Consensus Changes

Field Old Value New Value Comment
prefLabel [{'@value': 'Dimethyltetrachloroterephthalate', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'bootstrap_labels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['EF 3.1'], 'prov:wasDerivedFrom': 'legacy name field'}}] [{'@value': 'Dacthal', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:1861-32-1'], 'prov:wasDerivedFrom': 'Common Chemistry / ChEBI primary name agreement'}}] cas=1861-32-1; cc_chebi_agreed_name='Dacthal'; object_uuid=fo-8016443146f95296
altLabel [{'@value': 'Chlorthal-dimethyl', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:Chlorthal-dimethyl', 'http://purl.obolibrary.org/obo/CHEBI_34664', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': 'Dacthal', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:Dacthal', 'http://purl.obolibrary.org/obo/CHEBI_34664', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': 'Dimethyl 2,3,5,6-tetrachloroterephthalate', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:Dimethyl 2,3,5,6-tetrachloroterephthalate', 'http://purl.obolibrary.org/obo/CHEBI_34664', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}] [{'@value': 'Chlorthal-dimethyl', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:Chlorthal-dimethyl', 'http://purl.obolibrary.org/obo/CHEBI_34664', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': 'Dimethyl 2,3,5,6-tetrachloroterephthalate', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:Dimethyl 2,3,5,6-tetrachloroterephthalate', 'http://purl.obolibrary.org/obo/CHEBI_34664', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': 'Dimethyltetrachloroterephthalate', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['EF 3.1'], 'prov:wasDerivedFrom': 'original name retained as altLabel'}}] cas=1861-32-1; added original name as altLabel after CC/ChEBI rename; object_uuid=fo-8016443146f95296
altLabel [{'@value': 'Chlorthal-dimethyl', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:Chlorthal-dimethyl', 'http://purl.obolibrary.org/obo/CHEBI_34664', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': 'Dimethyl 2,3,5,6-tetrachloroterephthalate', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:Dimethyl 2,3,5,6-tetrachloroterephthalate', 'http://purl.obolibrary.org/obo/CHEBI_34664', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': 'Dimethyltetrachloroterephthalate', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['EF 3.1'], 'prov:wasDerivedFrom': 'original name retained as altLabel'}}] [{'@value': 'Chlorthal-dimethyl', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:Chlorthal-dimethyl', 'http://purl.obolibrary.org/obo/CHEBI_34664', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': 'Dimethyl 2,3,5,6-tetrachloroterephthalate', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:Dimethyl 2,3,5,6-tetrachloroterephthalate', 'http://purl.obolibrary.org/obo/CHEBI_34664', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': '1,4-Benzenedicarboxylic acid, 2,3,5,6-tetrachloro-, 1,4-dimethyl ester', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:1861-32-1', 'https://commonchemistry.cas.org/detail?cas_rn=1861-32-1'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': '1,4-Benzenedicarboxylic acid, 2,3,5,6-tetrachloro-, dimethyl ester', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:1861-32-1', 'https://commonchemistry.cas.org/detail?cas_rn=1861-32-1'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': '1,4-Dimethyl 2,3,5,6-tetrachlorobenzene-1,4-dicarboxylate', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:1861-32-1', 'https://commonchemistry.cas.org/detail?cas_rn=1861-32-1'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': '2,3,5,6-Tetrachloro-1,4-benzenedicarboxylic acid dimethyl ester', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:1861-32-1', 'https://commonchemistry.cas.org/detail?cas_rn=1861-32-1'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Cepos', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:1861-32-1', 'https://commonchemistry.cas.org/detail?cas_rn=1861-32-1'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Chlorthal dimethyl ester', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:1861-32-1', 'https://commonchemistry.cas.org/detail?cas_rn=1861-32-1'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Chlorthal-methyl', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:1861-32-1', 'https://commonchemistry.cas.org/detail?cas_rn=1861-32-1'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'DAC 893', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:1861-32-1', 'https://commonchemistry.cas.org/detail?cas_rn=1861-32-1'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'DCPA', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:1861-32-1', 'https://commonchemistry.cas.org/detail?cas_rn=1861-32-1'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'DCPA (herbicide)', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:1861-32-1', 'https://commonchemistry.cas.org/detail?cas_rn=1861-32-1'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Dac 4', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:1861-32-1', 'https://commonchemistry.cas.org/detail?cas_rn=1861-32-1'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Dimethyl tetrachloroterephthalate', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:1861-32-1', 'https://commonchemistry.cas.org/detail?cas_rn=1861-32-1'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'NSC 155745', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:1861-32-1', 'https://commonchemistry.cas.org/detail?cas_rn=1861-32-1'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'TCTP', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:1861-32-1', 'https://commonchemistry.cas.org/detail?cas_rn=1861-32-1'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Terephthalic acid, tetrachloro-, dimethyl ester', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:1861-32-1', 'https://commonchemistry.cas.org/detail?cas_rn=1861-32-1'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Tetrachloroterephthalic acid dimethyl ester', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:1861-32-1', 'https://commonchemistry.cas.org/detail?cas_rn=1861-32-1'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Tetral', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:1861-32-1', 'https://commonchemistry.cas.org/detail?cas_rn=1861-32-1'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}] group_key=dimethyltetrachloroterephthalate||dimension=Environmental > media=Air > strata=Aircraft cruise height; cas=1861-32-1; added Common Chemistry CAS names as altLabel: 1,4-Benzenedicarboxylic acid, 2,3,5,6-tetrachloro-, 1,4-dimethyl ester, 1,4-Benzenedicarboxylic acid, 2,3,5,6-tetrachloro-, dimethyl ester, 1,4-Dimethyl 2,3,5,6-tetrachlorobenzene-1,4-dicarboxylate, 2,3,5,6-Tetrachloro-1,4-benzenedicarboxylic acid dimethyl ester, Cepos, Chlorthal dimethyl ester, Chlorthal-methyl, DAC 893, DCPA, DCPA (herbicide), Dac 4, Dimethyl tetrachloroterephthalate, NSC 155745, TCTP, Terephthalic acid, tetrachloro-, dimethyl ester, Tetrachloroterephthalic acid dimethyl ester, Tetral; object_uuid=fo-8016443146f95296
cas_match_labels None {'1861-32-1': 'exactMatch'} group_key=dimethyltetrachloroterephthalate||dimension=Environmental > media=Air > strata=Aircraft cruise height; group_sources=['chebi', 'ec_inventory']; cas_sources={'1861-32-1': ['chebi', 'ec_inventory']}; assigned CAS labels from group consensus; object_uuid=fo-8016443146f95296: {'1861-32-1': 'exactMatch'}

PROV-O Consensus Activity Trail

No PROV-O consensus activities found for this flow.

Full Flow JSON

{
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  "name": null,
  "cas_numbers": [
    "1861-32-1"
  ],
  "ec_numbers": [
    "217-464-7"
  ],
  "context": {
    "dimension": "Environmental",
    "media": "Water",
    "water_body": "Unknown"
  },
  "general_comment": null,
  "synonyms": [],
  "unit": "kg",
  "lcia_methods": [],
  "source": "EF 3.1",
  "identifier": "4d9a8790-3ddd-11dd-9874-0050c2490048",
  "input_datasets": [
    "EF 3.1"
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  "source_refs": [
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      "list_version": "3.1",
      "source_flow_uuid": "4d9a8790-3ddd-11dd-9874-0050c2490048",
      "source_flow_name": "dimethyltetrachloroterephthalate",
      "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": "Dacthal",
      "@language": "en",
      "source": {
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        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
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        "prov:wasDerivedFrom": "Common Chemistry / ChEBI primary name agreement"
      }
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  "_sources": {
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    "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"
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  "context_iri": "https://vocab.brightway.one/flow-contexts/envi-wate-unkn",
  "unit_iri": "https://vocab.brightway.one/units/unit/KiloGM",
  "properties": {
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      "rdfs:label": "Molecular formula",
      "provenance": [
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        "COC(=O)c1c(Cl)c(Cl)c(C(=O)OC)c(Cl)c1Cl"
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      "rdfs:label": "SMILES",
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      "@value": [
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      ],
      "rdfs:label": "InChI",
      "provenance": [
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    "https://w3id.org/chemrof/inchi2d_key_string": {
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      "provenance": [
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    },
    "https://w3id.org/chemrof/molecular_mass": {
      "@id": "https://w3id.org/chemrof/molecular_mass",
      "@value": [
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      "rdfs:label": "Molecular mass",
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    },
    "https://w3id.org/chemrof/monoisotopic_mass": {
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    },
    "https://w3id.org/chemrof/formal_charge": {
      "@id": "https://w3id.org/chemrof/formal_charge",
      "@value": [
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      "rdfs:label": "Formal charge",
      "http://qudt.org/schema/qudt/hasUnit": "https://vocab.brightway.one/units/unit/NUM",
      "provenance": {
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        "prov:wasDerivedFrom": "chebi.basic_property_values.charge"
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    },
    "https://w3id.org/chemrof/IUPAC_name": {
      "@id": "https://w3id.org/chemrof/IUPAC_name",
      "@value": [
        "2,3,5,6-tetrachlorobenzene-1,4-dicarboxylic acid dimethyl ester",
        "dimethyl 2,3,5,6-tetrachlorobenzene-1,4-dicarboxylate",
        "dimethyl 2,3,5,6-tetrakis(chloranyl)benzene-1,4-dicarboxylate"
      ],
      "rdfs:label": "IUPAC name",
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