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Chlordimeform

UUID 37d6a8b0-f711-4ab8-a90a-40891e5e2a9e
Flow Object IDfo-ba4a6901e69025c9
Source EF 3.1
Context Environmental → Air → Unknown
CAS Numbers 6164-98-3
EC Numbers 228-200-5
prefLabel
Language Value Provenance
en Chlordimeform
altLabel
Language Value Provenance
en Chlorphenamidine
en N'-(4-Chloro-2-methylphenyl)-N,N-dimethylformamidine
en N'-(4-chloro-2-methylphenyl)-N,N-dimethylimidoformamide
en N'-(4-chloro-2-methylphenyl)-N,N-dimethylmethanimidamide
en N'-(4-chloro-o-tolyl)-N,N-dimethylformamidine
en N(2)-(4-chloro-o-tolyl)-N(1),N(1)-dimethylformamidine
en 1-(2-Methyl-4-chlorophenyl)-3,3-dimethylformamidine
en <em>N</em>,<em>N</em>-Dimethyl-<em>N</em>′-(2-methyl-4-chlorophenyl)formamidine
en <em>N</em>′-(2-Methyl-4-chlorophenyl)-<em>N</em>,<em>N</em>-dimethylformamidine
en <em>N</em>′-(4-Chloro-2-methylphenyl)-<em>N</em>,<em>N</em>-dimethylmethanimidamide
en <em>N</em>′-(4-Chloro-<em>o</em>-tolyl)-<em>N</em>,<em>N</em>-dimethylformamidine
en <em>N</em>′-(<em>p</em>-Chloro-<em>o</em>-tolyl)-<em>N</em>,<em>N</em>-dimethylformamidine
en Acaron
en C 8514
en CDM
en CDM (acaricide)
en CIBA 8514
en Chlorophenamidin
en Chlorophenamidine
en Formamidine, <em>N</em>,<em>N</em>-dimethyl-<em>N</em>′-(2-methyl-4-chlorophenyl)-
en Formamidine, <em>N</em>′-(4-chloro-<em>o</em>-tolyl)-<em>N</em>,<em>N</em>-dimethyl-
en Fundal
en Fundal 500
en Galecron
en Methanimidamide, <em>N</em>′-(4-chloro-2-methylphenyl)-<em>N</em>,<em>N</em>-dimethyl-
en RS 141
en Schering 36,268
References
Shared Properties
Predicate Value
Formal charge 0
InChIKey STUSTWKEFDQFFZ-KPKJPENVSA-N, STUSTWKEFDQFFZ-UHFFFAOYSA-N
InChI InChI=1S/C10H13ClN2/c1-8-6-9(11)4-5-10(8)12-7-13(2)3/h4-7H,1-3H3, InChI=1S/C10H13ClN2/c1-8-6-9(11)4-5-10(8)12-7-13(2)3/h4-7H,1-3H3/b12-7+
IUPAC name N'-(4-chloranyl-2-methyl-phenyl)-N,N-dimethyl-methanimidamide, N'-(4-chloro-2-methyl-phenyl)-N,N-dimethyl-formamidine, N'-(4-chloro-2-methylphenyl)-N,N-dimethylmethanimidamide
Molecular formula C10H13ClN2
Molecular mass 196.681
Monoisotopic mass 196.07673
SMILES CC1=C(C=CC(=C1)Cl)N=CN(C)C, Cc1cc(Cl)ccc1/N=C/N(C)C

Source List References

List Version Source Flow UUID Source Flow Name
EF 3.1 37d6a8b0-f711-4ab8-a90a-40891e5e2a9e chlordimeform

Concept Associations

Source List Source Flow Source Context Unit Match Type Conversion Provenance
EF 3.1 chlordimeform Emissions/Emissions to air/Emissions to air, unspecified kg exactMatch

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=chlordimeform||dimension=Environmental > media=Air > strata=Ground level > population_density=Urban (>1000 people/square mile); cas=6164-98-3; added Common Chemistry CAS names as altLabel: 1-(2-Methyl-4-chlorophenyl)-3,3-dimethylformamidine, <em>N</em>,<em>N</em>-Dimethyl-<em>N</em>′-(2-methyl-4-chlorophenyl)formamidine, <em>N</em>′-(2-Methyl-4-chlorophenyl)-<em>N</em>,<em>N</em>-dimethylformamidine, <em>N</em>′-(4-Chloro-2-methylphenyl)-<em>N</em>,<em>N</em>-dimethylmethanimidamide, <em>N</em>′-(4-Chloro-<em>o</em>-tolyl)-<em>N</em>,<em>N</em>-dimethylformamidine, <em>N</em>′-(<em>p</em>-Chloro-<em>o</em>-tolyl)-<em>N</em>,<em>N</em>-dimethylformamidine, Acaron, C 8514, CDM, CDM (acaricide), CIBA 8514, Chlorophenamidin, Chlorophenamidine, Formamidine, <em>N</em>,<em>N</em>-dimethyl-<em>N</em>′-(2-methyl-4-chlorophenyl)-, Formamidine, <em>N</em>′-(4-chloro-<em>o</em>-tolyl)-<em>N</em>,<em>N</em>-dimethyl-, Fundal, Fundal 500, Galecron, Methanimidamide, <em>N</em>′-(4-chloro-2-methylphenyl)-<em>N</em>,<em>N</em>-dimethyl-, RS 141, Schering 36,268; object_uuid=fo-ba4a6901e69025c9
cas_match_labels 1 consensus_match group_key=chlordimeform||dimension=Environmental > media=Air > strata=Ground level > population_density=Urban (>1000 people/square mile); group_sources=['chebi', 'ec_inventory', 'pubchem']; cas_sources={'6164-98-3': ['chebi', 'ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-ba4a6901e69025c9: {'6164-98-3': 'exactMatch'}

Context Attributes

AttributeValue
dimensionEnvironmental
mediaAir
strataUnknown

Consensus Changes

Field Old Value New Value Comment
altLabel [{'@value': 'Chlorphenamidine', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:Chlorphenamidine', 'http://purl.obolibrary.org/obo/CHEBI_34629', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': "N'-(4-Chloro-2-methylphenyl)-N,N-dimethylformamidine", '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ["label:N'-(4-Chloro-2-methylphenyl)-N,N-dimethylformamidine", 'http://purl.obolibrary.org/obo/CHEBI_34629', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': "N'-(4-chloro-2-methylphenyl)-N,N-dimethylimidoformamide", '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ["label:N'-(4-chloro-2-methylphenyl)-N,N-dimethylimidoformamide", 'http://purl.obolibrary.org/obo/CHEBI_34629', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': "N'-(4-chloro-2-methylphenyl)-N,N-dimethylmethanimidamide", '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ["label:N'-(4-chloro-2-methylphenyl)-N,N-dimethylmethanimidamide", 'http://purl.obolibrary.org/obo/CHEBI_34629', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': "N'-(4-chloro-o-tolyl)-N,N-dimethylformamidine", '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ["label:N'-(4-chloro-o-tolyl)-N,N-dimethylformamidine", 'http://purl.obolibrary.org/obo/CHEBI_34629', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': 'N(2)-(4-chloro-o-tolyl)-N(1),N(1)-dimethylformamidine', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:N(2)-(4-chloro-o-tolyl)-N(1),N(1)-dimethylformamidine', 'http://purl.obolibrary.org/obo/CHEBI_34629', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}] [{'@value': 'Chlorphenamidine', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:Chlorphenamidine', 'http://purl.obolibrary.org/obo/CHEBI_34629', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': "N'-(4-Chloro-2-methylphenyl)-N,N-dimethylformamidine", '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ["label:N'-(4-Chloro-2-methylphenyl)-N,N-dimethylformamidine", 'http://purl.obolibrary.org/obo/CHEBI_34629', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': "N'-(4-chloro-2-methylphenyl)-N,N-dimethylimidoformamide", '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ["label:N'-(4-chloro-2-methylphenyl)-N,N-dimethylimidoformamide", 'http://purl.obolibrary.org/obo/CHEBI_34629', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': "N'-(4-chloro-2-methylphenyl)-N,N-dimethylmethanimidamide", '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ["label:N'-(4-chloro-2-methylphenyl)-N,N-dimethylmethanimidamide", 'http://purl.obolibrary.org/obo/CHEBI_34629', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': "N'-(4-chloro-o-tolyl)-N,N-dimethylformamidine", '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ["label:N'-(4-chloro-o-tolyl)-N,N-dimethylformamidine", 'http://purl.obolibrary.org/obo/CHEBI_34629', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': 'N(2)-(4-chloro-o-tolyl)-N(1),N(1)-dimethylformamidine', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:N(2)-(4-chloro-o-tolyl)-N(1),N(1)-dimethylformamidine', 'http://purl.obolibrary.org/obo/CHEBI_34629', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': '1-(2-Methyl-4-chlorophenyl)-3,3-dimethylformamidine', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:6164-98-3', 'https://commonchemistry.cas.org/detail?cas_rn=6164-98-3'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': '<em>N</em>,<em>N</em>-Dimethyl-<em>N</em>′-(2-methyl-4-chlorophenyl)formamidine', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:6164-98-3', 'https://commonchemistry.cas.org/detail?cas_rn=6164-98-3'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': '<em>N</em>′-(2-Methyl-4-chlorophenyl)-<em>N</em>,<em>N</em>-dimethylformamidine', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:6164-98-3', 'https://commonchemistry.cas.org/detail?cas_rn=6164-98-3'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': '<em>N</em>′-(4-Chloro-2-methylphenyl)-<em>N</em>,<em>N</em>-dimethylmethanimidamide', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:6164-98-3', 'https://commonchemistry.cas.org/detail?cas_rn=6164-98-3'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': '<em>N</em>′-(4-Chloro-<em>o</em>-tolyl)-<em>N</em>,<em>N</em>-dimethylformamidine', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:6164-98-3', 'https://commonchemistry.cas.org/detail?cas_rn=6164-98-3'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': '<em>N</em>′-(<em>p</em>-Chloro-<em>o</em>-tolyl)-<em>N</em>,<em>N</em>-dimethylformamidine', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:6164-98-3', 'https://commonchemistry.cas.org/detail?cas_rn=6164-98-3'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Acaron', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:6164-98-3', 'https://commonchemistry.cas.org/detail?cas_rn=6164-98-3'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'C 8514', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:6164-98-3', 'https://commonchemistry.cas.org/detail?cas_rn=6164-98-3'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'CDM', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:6164-98-3', 'https://commonchemistry.cas.org/detail?cas_rn=6164-98-3'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'CDM (acaricide)', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:6164-98-3', 'https://commonchemistry.cas.org/detail?cas_rn=6164-98-3'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'CIBA 8514', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:6164-98-3', 'https://commonchemistry.cas.org/detail?cas_rn=6164-98-3'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Chlorophenamidin', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:6164-98-3', 'https://commonchemistry.cas.org/detail?cas_rn=6164-98-3'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Chlorophenamidine', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:6164-98-3', 'https://commonchemistry.cas.org/detail?cas_rn=6164-98-3'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Formamidine, <em>N</em>,<em>N</em>-dimethyl-<em>N</em>′-(2-methyl-4-chlorophenyl)-', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:6164-98-3', 'https://commonchemistry.cas.org/detail?cas_rn=6164-98-3'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Formamidine, <em>N</em>′-(4-chloro-<em>o</em>-tolyl)-<em>N</em>,<em>N</em>-dimethyl-', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:6164-98-3', 'https://commonchemistry.cas.org/detail?cas_rn=6164-98-3'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Fundal', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:6164-98-3', 'https://commonchemistry.cas.org/detail?cas_rn=6164-98-3'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Fundal 500', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:6164-98-3', 'https://commonchemistry.cas.org/detail?cas_rn=6164-98-3'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Galecron', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:6164-98-3', 'https://commonchemistry.cas.org/detail?cas_rn=6164-98-3'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Methanimidamide, <em>N</em>′-(4-chloro-2-methylphenyl)-<em>N</em>,<em>N</em>-dimethyl-', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:6164-98-3', 'https://commonchemistry.cas.org/detail?cas_rn=6164-98-3'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'RS 141', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:6164-98-3', 'https://commonchemistry.cas.org/detail?cas_rn=6164-98-3'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Schering 36,268', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:6164-98-3', 'https://commonchemistry.cas.org/detail?cas_rn=6164-98-3'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}] group_key=chlordimeform||dimension=Environmental > media=Air > strata=Ground level > population_density=Urban (>1000 people/square mile); cas=6164-98-3; added Common Chemistry CAS names as altLabel: 1-(2-Methyl-4-chlorophenyl)-3,3-dimethylformamidine, <em>N</em>,<em>N</em>-Dimethyl-<em>N</em>′-(2-methyl-4-chlorophenyl)formamidine, <em>N</em>′-(2-Methyl-4-chlorophenyl)-<em>N</em>,<em>N</em>-dimethylformamidine, <em>N</em>′-(4-Chloro-2-methylphenyl)-<em>N</em>,<em>N</em>-dimethylmethanimidamide, <em>N</em>′-(4-Chloro-<em>o</em>-tolyl)-<em>N</em>,<em>N</em>-dimethylformamidine, <em>N</em>′-(<em>p</em>-Chloro-<em>o</em>-tolyl)-<em>N</em>,<em>N</em>-dimethylformamidine, Acaron, C 8514, CDM, CDM (acaricide), CIBA 8514, Chlorophenamidin, Chlorophenamidine, Formamidine, <em>N</em>,<em>N</em>-dimethyl-<em>N</em>′-(2-methyl-4-chlorophenyl)-, Formamidine, <em>N</em>′-(4-chloro-<em>o</em>-tolyl)-<em>N</em>,<em>N</em>-dimethyl-, Fundal, Fundal 500, Galecron, Methanimidamide, <em>N</em>′-(4-chloro-2-methylphenyl)-<em>N</em>,<em>N</em>-dimethyl-, RS 141, Schering 36,268; object_uuid=fo-ba4a6901e69025c9
cas_match_labels None {'6164-98-3': 'exactMatch'} group_key=chlordimeform||dimension=Environmental > media=Air > strata=Ground level > population_density=Urban (>1000 people/square mile); group_sources=['chebi', 'ec_inventory', 'pubchem']; cas_sources={'6164-98-3': ['chebi', 'ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-ba4a6901e69025c9: {'6164-98-3': 'exactMatch'}

PROV-O Consensus Activity Trail

No PROV-O consensus activities found for this flow.

Full Flow JSON

{
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  "name": null,
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  "context": {
    "dimension": "Environmental",
    "media": "Air",
    "strata": "Unknown"
  },
  "general_comment": null,
  "synonyms": [],
  "unit": "kg",
  "lcia_methods": [
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      "methodology": "Environmental Footprint",
      "impact_category": "Non-cancer human health effects",
      "impact_indicator": "Comparative Toxic Unit for human (CTUh)",
      "characterization_factor": 0.000014533
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    {
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      "name": "Human toxicity, non-cancer_organics",
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      "impact_indicator": "Comparative Toxic Unit for human (CTUh)",
      "characterization_factor": 0.000014533
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      "name": "Ecotoxicity, freshwater_organics",
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      "characterization_factor": 25.062
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  "source": "EF 3.1",
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      "source_metadata": {
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        "input_dataset": "EF 3.1",
        "original_context": [
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          "Emissions to air",
          "Emissions to air, unspecified"
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  "prefLabel": [
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  "_sources": {
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  "properties": {
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      "@value": [
        "C10H13ClN2"
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      "rdfs:label": "Molecular formula",
      "provenance": [
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