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2,4-dichlorobenzoyl Chloride

2D structure
Flow Object IDfo-634144194e339569
TypeConsensus
prefLabel
Label Language
2,4-dichlorobenzoyl Chloride en
Alt Labels
Label Language Provenance
<em>o</em>,<em>p</em>-Dichlorobenzoyl chloride en —
Benzoyl chloride, 2,4-dichloro- en —
CAS Numbers 89-75-8
EC Numbers 201-936-4
Changes Applied26

Provenance

Field Value
Resolverhybrid_name_cas_v1
Seed SourceEF 3.1
Seed Flow13c2cb8f-eefd-49a7-955b-99157b7fca29

Properties

Predicate Value
InChIKey CEOCVKWBUWKBKA-UHFFFAOYSA-N, VOGJJIQUEMRFQF-UHFFFAOYSA-N
InChI InChI=1S/C18H28N2O/c1-15-6-4-10-19(12-15)13-17(21)14-20-11-5-8-16-7-2-3-9-18(16)20/h2-3,7,9,15,17,21H,4-6,8,10-14H2,1H3, InChI=1S/C7H3Cl3O/c8-4-1-2-5(7(10)11)6(9)3-4/h1-3H
IUPAC name 1-(3,4-dihydro-2H-quinolin-1-yl)-3-(3-methyl-1-piperidinyl)-2-propanol, 1-(3,4-dihydro-2H-quinolin-1-yl)-3-(3-methyl-1-piperidyl)propan-2-ol, 1-(3,4-dihydro-2H-quinolin-1-yl)-3-(3-methylpiperidin-1-yl)propan-2-ol, 1-(3,4-dihydro-2H-quinolin-1-yl)-3-(3-methylpiperidino)propan-2-ol, 2,4-bis(chloranyl)benzoyl chloride, 2,4-dichlorobenzoyl chloride
Molecular formula C18H28N2O, C7H3Cl3O
Molecular mass 209.459
Monoisotopic mass 207.924948
SMILES C1=CC(=C(C=C1Cl)Cl)C(=O)Cl, CC1CCCN(C1)CC(CN2CCCC3=CC=CC=C32)O, O=C(Cl)c1ccc(Cl)cc1Cl

References

Linked Elementary Flows

UUID Source Unit Context LCIA Factors Consensus Changes
c80aadd5… EF 3.1 kg Environmental → Air → Aircraft cruise height 2 2
41b6a077… EF 3.1 kg Environmental → Air → Ground level → Rural (<1000 people/square mile) 0 2
7f579f8f… EF 3.1 kg Environmental → Air → Ground level → Urban (>1000 people/square mile) 2 2
ffb07f5c… EF 3.1 kg Environmental → Air → High stack, >150 meters 2 2
28ec18eb… EF 3.1 kg Environmental → Air → Unknown 2 2
6717e52a… EF 3.1 kg Environmental → Air → Unknown 2 2
a65ff436… EF 3.1 kg Environmental → Ground → Agricultural 2 2
5f84f23a… EF 3.1 kg Environmental → Ground → Unknown 2 2
9da421c9… EF 3.1 kg Environmental → Water → Ocean 2 2
253950d3… EF 3.1 kg Environmental → Water → Surface water 2 2
de813551… EF 3.1 kg Environmental → Water → Unknown 2 2
▶

Changes Applied
Elementary Flow Field Old Value New Value Comment
13c2cb8f… altLabel — [{"@value":"<em>o</em>,<em>p</em>-Dichlorobenzoyl chloride","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:89-75-8","https://commonchemistry.cas.org/detail?cas_rn=89-75-8"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}},{"@value":"Benzoyl chloride, 2,4-dichloro-","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:89-75-8","https://commonchemistry.cas.org/detail?cas_rn=89-75-8"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}}] group_key=2,4-dichlorobenzoylchloride||dimension=Environmental > media=Water > water_body=Unknown; cas=89-75-8; added Common Chemistry CAS names as altLabel: <em>o</em>,<em>p</em>-Dichlorobenzoyl chloride, Benzoyl chloride, 2,4-dichloro-; object_uuid=fo-634144194e339569
13c2cb8f… cas_match_labels — {"89-75-8":"exactMatch"} group_key=2,4-dichlorobenzoylchloride||dimension=Environmental > media=Water > water_body=Unknown; group_sources=['ec_inventory', 'pubchem']; cas_sources={'89-75-8': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-634144194e339569: {'89-75-8': 'exactMatch'}
253950d3… altLabel — [{"@value":"<em>o</em>,<em>p</em>-Dichlorobenzoyl chloride","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:89-75-8","https://commonchemistry.cas.org/detail?cas_rn=89-75-8"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}},{"@value":"Benzoyl chloride, 2,4-dichloro-","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:89-75-8","https://commonchemistry.cas.org/detail?cas_rn=89-75-8"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}}] group_key=2,4-dichlorobenzoylchloride||dimension=Environmental > media=Water > water_body=Unknown; cas=89-75-8; added Common Chemistry CAS names as altLabel: <em>o</em>,<em>p</em>-Dichlorobenzoyl chloride, Benzoyl chloride, 2,4-dichloro-; object_uuid=fo-634144194e339569
253950d3… cas_match_labels — {"89-75-8":"exactMatch"} group_key=2,4-dichlorobenzoylchloride||dimension=Environmental > media=Water > water_body=Unknown; group_sources=['ec_inventory', 'pubchem']; cas_sources={'89-75-8': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-634144194e339569: {'89-75-8': 'exactMatch'}
28ec18eb… altLabel — [{"@value":"<em>o</em>,<em>p</em>-Dichlorobenzoyl chloride","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:89-75-8","https://commonchemistry.cas.org/detail?cas_rn=89-75-8"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}},{"@value":"Benzoyl chloride, 2,4-dichloro-","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:89-75-8","https://commonchemistry.cas.org/detail?cas_rn=89-75-8"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}}] group_key=2,4-dichlorobenzoylchloride||dimension=Environmental > media=Water > water_body=Unknown; cas=89-75-8; added Common Chemistry CAS names as altLabel: <em>o</em>,<em>p</em>-Dichlorobenzoyl chloride, Benzoyl chloride, 2,4-dichloro-; object_uuid=fo-634144194e339569
28ec18eb… cas_match_labels — {"89-75-8":"exactMatch"} group_key=2,4-dichlorobenzoylchloride||dimension=Environmental > media=Water > water_body=Unknown; group_sources=['ec_inventory', 'pubchem']; cas_sources={'89-75-8': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-634144194e339569: {'89-75-8': 'exactMatch'}
41b6a077… altLabel — [{"@value":"<em>o</em>,<em>p</em>-Dichlorobenzoyl chloride","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:89-75-8","https://commonchemistry.cas.org/detail?cas_rn=89-75-8"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}},{"@value":"Benzoyl chloride, 2,4-dichloro-","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:89-75-8","https://commonchemistry.cas.org/detail?cas_rn=89-75-8"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}}] group_key=2,4-dichlorobenzoylchloride||dimension=Environmental > media=Water > water_body=Unknown; cas=89-75-8; added Common Chemistry CAS names as altLabel: <em>o</em>,<em>p</em>-Dichlorobenzoyl chloride, Benzoyl chloride, 2,4-dichloro-; object_uuid=fo-634144194e339569
41b6a077… cas_match_labels — {"89-75-8":"exactMatch"} group_key=2,4-dichlorobenzoylchloride||dimension=Environmental > media=Water > water_body=Unknown; group_sources=['ec_inventory', 'pubchem']; cas_sources={'89-75-8': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-634144194e339569: {'89-75-8': 'exactMatch'}
5f84f23a… altLabel — [{"@value":"<em>o</em>,<em>p</em>-Dichlorobenzoyl chloride","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:89-75-8","https://commonchemistry.cas.org/detail?cas_rn=89-75-8"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}},{"@value":"Benzoyl chloride, 2,4-dichloro-","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:89-75-8","https://commonchemistry.cas.org/detail?cas_rn=89-75-8"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}}] group_key=2,4-dichlorobenzoylchloride||dimension=Environmental > media=Water > water_body=Unknown; cas=89-75-8; added Common Chemistry CAS names as altLabel: <em>o</em>,<em>p</em>-Dichlorobenzoyl chloride, Benzoyl chloride, 2,4-dichloro-; object_uuid=fo-634144194e339569
5f84f23a… cas_match_labels — {"89-75-8":"exactMatch"} group_key=2,4-dichlorobenzoylchloride||dimension=Environmental > media=Water > water_body=Unknown; group_sources=['ec_inventory', 'pubchem']; cas_sources={'89-75-8': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-634144194e339569: {'89-75-8': 'exactMatch'}
6717e52a… altLabel — [{"@value":"<em>o</em>,<em>p</em>-Dichlorobenzoyl chloride","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:89-75-8","https://commonchemistry.cas.org/detail?cas_rn=89-75-8"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}},{"@value":"Benzoyl chloride, 2,4-dichloro-","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:89-75-8","https://commonchemistry.cas.org/detail?cas_rn=89-75-8"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}}] group_key=2,4-dichlorobenzoylchloride||dimension=Environmental > media=Water > water_body=Unknown; cas=89-75-8; added Common Chemistry CAS names as altLabel: <em>o</em>,<em>p</em>-Dichlorobenzoyl chloride, Benzoyl chloride, 2,4-dichloro-; object_uuid=fo-634144194e339569
6717e52a… cas_match_labels — {"89-75-8":"exactMatch"} group_key=2,4-dichlorobenzoylchloride||dimension=Environmental > media=Water > water_body=Unknown; group_sources=['ec_inventory', 'pubchem']; cas_sources={'89-75-8': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-634144194e339569: {'89-75-8': 'exactMatch'}
7f579f8f… altLabel — [{"@value":"<em>o</em>,<em>p</em>-Dichlorobenzoyl chloride","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:89-75-8","https://commonchemistry.cas.org/detail?cas_rn=89-75-8"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}},{"@value":"Benzoyl chloride, 2,4-dichloro-","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:89-75-8","https://commonchemistry.cas.org/detail?cas_rn=89-75-8"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}}] group_key=2,4-dichlorobenzoylchloride||dimension=Environmental > media=Water > water_body=Unknown; cas=89-75-8; added Common Chemistry CAS names as altLabel: <em>o</em>,<em>p</em>-Dichlorobenzoyl chloride, Benzoyl chloride, 2,4-dichloro-; object_uuid=fo-634144194e339569
7f579f8f… cas_match_labels — {"89-75-8":"exactMatch"} group_key=2,4-dichlorobenzoylchloride||dimension=Environmental > media=Water > water_body=Unknown; group_sources=['ec_inventory', 'pubchem']; cas_sources={'89-75-8': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-634144194e339569: {'89-75-8': 'exactMatch'}
9da421c9… altLabel — [{"@value":"<em>o</em>,<em>p</em>-Dichlorobenzoyl chloride","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:89-75-8","https://commonchemistry.cas.org/detail?cas_rn=89-75-8"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}},{"@value":"Benzoyl chloride, 2,4-dichloro-","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:89-75-8","https://commonchemistry.cas.org/detail?cas_rn=89-75-8"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}}] group_key=2,4-dichlorobenzoylchloride||dimension=Environmental > media=Water > water_body=Unknown; cas=89-75-8; added Common Chemistry CAS names as altLabel: <em>o</em>,<em>p</em>-Dichlorobenzoyl chloride, Benzoyl chloride, 2,4-dichloro-; object_uuid=fo-634144194e339569
9da421c9… cas_match_labels — {"89-75-8":"exactMatch"} group_key=2,4-dichlorobenzoylchloride||dimension=Environmental > media=Water > water_body=Unknown; group_sources=['ec_inventory', 'pubchem']; cas_sources={'89-75-8': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-634144194e339569: {'89-75-8': 'exactMatch'}
a65ff436… altLabel — [{"@value":"<em>o</em>,<em>p</em>-Dichlorobenzoyl chloride","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:89-75-8","https://commonchemistry.cas.org/detail?cas_rn=89-75-8"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}},{"@value":"Benzoyl chloride, 2,4-dichloro-","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:89-75-8","https://commonchemistry.cas.org/detail?cas_rn=89-75-8"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}}] group_key=2,4-dichlorobenzoylchloride||dimension=Environmental > media=Water > water_body=Unknown; cas=89-75-8; added Common Chemistry CAS names as altLabel: <em>o</em>,<em>p</em>-Dichlorobenzoyl chloride, Benzoyl chloride, 2,4-dichloro-; object_uuid=fo-634144194e339569
a65ff436… cas_match_labels — {"89-75-8":"exactMatch"} group_key=2,4-dichlorobenzoylchloride||dimension=Environmental > media=Water > water_body=Unknown; group_sources=['ec_inventory', 'pubchem']; cas_sources={'89-75-8': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-634144194e339569: {'89-75-8': 'exactMatch'}
b433ff48… altLabel — [{"@value":"<em>o</em>,<em>p</em>-Dichlorobenzoyl chloride","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:89-75-8","https://commonchemistry.cas.org/detail?cas_rn=89-75-8"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}},{"@value":"Benzoyl chloride, 2,4-dichloro-","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:89-75-8","https://commonchemistry.cas.org/detail?cas_rn=89-75-8"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}}] group_key=2,4-dichlorobenzoylchloride||dimension=Environmental > media=Water > water_body=Unknown; cas=89-75-8; added Common Chemistry CAS names as altLabel: <em>o</em>,<em>p</em>-Dichlorobenzoyl chloride, Benzoyl chloride, 2,4-dichloro-; object_uuid=fo-634144194e339569
b433ff48… cas_match_labels — {"89-75-8":"exactMatch"} group_key=2,4-dichlorobenzoylchloride||dimension=Environmental > media=Water > water_body=Unknown; group_sources=['ec_inventory', 'pubchem']; cas_sources={'89-75-8': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-634144194e339569: {'89-75-8': 'exactMatch'}
c80aadd5… altLabel — [{"@value":"<em>o</em>,<em>p</em>-Dichlorobenzoyl chloride","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:89-75-8","https://commonchemistry.cas.org/detail?cas_rn=89-75-8"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}},{"@value":"Benzoyl chloride, 2,4-dichloro-","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:89-75-8","https://commonchemistry.cas.org/detail?cas_rn=89-75-8"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}}] group_key=2,4-dichlorobenzoylchloride||dimension=Environmental > media=Water > water_body=Unknown; cas=89-75-8; added Common Chemistry CAS names as altLabel: <em>o</em>,<em>p</em>-Dichlorobenzoyl chloride, Benzoyl chloride, 2,4-dichloro-; object_uuid=fo-634144194e339569
c80aadd5… cas_match_labels — {"89-75-8":"exactMatch"} group_key=2,4-dichlorobenzoylchloride||dimension=Environmental > media=Water > water_body=Unknown; group_sources=['ec_inventory', 'pubchem']; cas_sources={'89-75-8': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-634144194e339569: {'89-75-8': 'exactMatch'}
de813551… altLabel — [{"@value":"<em>o</em>,<em>p</em>-Dichlorobenzoyl chloride","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:89-75-8","https://commonchemistry.cas.org/detail?cas_rn=89-75-8"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}},{"@value":"Benzoyl chloride, 2,4-dichloro-","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:89-75-8","https://commonchemistry.cas.org/detail?cas_rn=89-75-8"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}}] group_key=2,4-dichlorobenzoylchloride||dimension=Environmental > media=Water > water_body=Unknown; cas=89-75-8; added Common Chemistry CAS names as altLabel: <em>o</em>,<em>p</em>-Dichlorobenzoyl chloride, Benzoyl chloride, 2,4-dichloro-; object_uuid=fo-634144194e339569
de813551… cas_match_labels — {"89-75-8":"exactMatch"} group_key=2,4-dichlorobenzoylchloride||dimension=Environmental > media=Water > water_body=Unknown; group_sources=['ec_inventory', 'pubchem']; cas_sources={'89-75-8': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-634144194e339569: {'89-75-8': 'exactMatch'}
ffb07f5c… altLabel — [{"@value":"<em>o</em>,<em>p</em>-Dichlorobenzoyl chloride","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:89-75-8","https://commonchemistry.cas.org/detail?cas_rn=89-75-8"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}},{"@value":"Benzoyl chloride, 2,4-dichloro-","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:89-75-8","https://commonchemistry.cas.org/detail?cas_rn=89-75-8"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}}] group_key=2,4-dichlorobenzoylchloride||dimension=Environmental > media=Water > water_body=Unknown; cas=89-75-8; added Common Chemistry CAS names as altLabel: <em>o</em>,<em>p</em>-Dichlorobenzoyl chloride, Benzoyl chloride, 2,4-dichloro-; object_uuid=fo-634144194e339569
ffb07f5c… cas_match_labels — {"89-75-8":"exactMatch"} group_key=2,4-dichlorobenzoylchloride||dimension=Environmental > media=Water > water_body=Unknown; group_sources=['ec_inventory', 'pubchem']; cas_sources={'89-75-8': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-634144194e339569: {'89-75-8': 'exactMatch'}

Flow Object JSON

{
  "flow_object_id": "fo-634144194e339569",
  "prefLabel": [
    {
      "@value": "2,4-dichlorobenzoyl Chloride",
      "@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": [
    {
      "@value": "<em>o</em>,<em>p</em>-Dichlorobenzoyl chloride",
      "@language": "en",
      "@lang": "en",
      "provenance": {
        "prov:wasGeneratedBy": "hybrid_name_cas_v1",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "EF 3.1"
        ],
        "prov:wasDerivedFrom": "altLabel"
      }
    },
    {
      "@value": "Benzoyl chloride, 2,4-dichloro-",
      "@language": "en",
      "@lang": "en",
      "provenance": {
        "prov:wasGeneratedBy": "hybrid_name_cas_v1",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "EF 3.1"
        ],
        "prov:wasDerivedFrom": "altLabel"
      }
    }
  ],
  "properties": {
    "https://w3id.org/chemrof/molecular_formula": {
      "@id": "https://w3id.org/chemrof/molecular_formula",
      "@value": [
        "C18H28N2O",
        "C7H3Cl3O"
      ],
      "rdfs:label": "Molecular formula",
      "provenance": [
        {
          "prov:wasGeneratedBy": "enrich_references.pubchem_semantic",
          "prov:wasAttributedTo": "consensus-flow-list",
          "prov:hadPrimarySource": [
            "CID:66645",
            "CID:247530"
          ],
          "prov:wasDerivedFrom": "pubchem.props.Molecular Formula"
        },
        {
          "prov:wasGeneratedBy": "rdkit_post_consensus",
          "prov:wasAttributedTo": "consensus-flow-list",
          "prov:hadPrimarySource": [
            "C1=CC(=C(C=C1Cl)Cl)C(=O)Cl"
          ]
        }
      ]
    },
    "https://w3id.org/chemrof/inchi2d_key_string": {
      "@id": "https://w3id.org/chemrof/inchi2d_key_string",
      "@value": [
        "CEOCVKWBUWKBKA-UHFFFAOYSA-N",
        "VOGJJIQUEMRFQF-UHFFFAOYSA-N"
      ],
      "rdfs:label": "InChIKey",
      "provenance": [
        {
          "prov:wasGeneratedBy": "enrich_references.pubchem_semantic",
          "prov:wasAttributedTo": "consensus-flow-list",
          "prov:hadPrimarySource": [
            "CID:66645",
            "CID:247530"
          ],
          "prov:wasDerivedFrom": "pubchem.props.InChIKey"
        },
        {
          "prov:wasGeneratedBy": "rdkit_post_consensus",
          "prov:wasAttributedTo": "consensus-flow-list",
          "prov:hadPrimarySource": [
            "C1=CC(=C(C=C1Cl)Cl)C(=O)Cl"
          ]
        }
      ]
    },
    "https://w3id.org/chemrof/smiles_string": {
      "@id": "https://w3id.org/chemrof/smiles_string",
      "@value": [
        "C1=CC(=C(C=C1Cl)Cl)C(=O)Cl",
        "CC1CCCN(C1)CC(CN2CCCC3=CC=CC=C32)O",
        "O=C(Cl)c1ccc(Cl)cc1Cl"
      ],
      "rdfs:label": "SMILES",
      "provenance": [
        {
          "prov:wasGeneratedBy": "enrich_references.pubchem_semantic",
          "prov:wasAttributedTo": "consensus-flow-list",
          "prov:hadPrimarySource": [
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          ],
          "prov:wasDerivedFrom": "pubchem.props.SMILES"
        },
        {
          "prov:wasGeneratedBy": "rdkit_pre_consensus",
          "prov:wasAttributedTo": "consensus-flow-list",
          "prov:hadPrimarySource": [
            "C1=CC(=C(C=C1Cl)Cl)C(=O)Cl"
          ]
        },
        {
          "prov:wasGeneratedBy": "rdkit_post_consensus",
          "prov:wasAttributedTo": "consensus-flow-list",
          "prov:hadPrimarySource": [
            "C1=CC(=C(C=C1Cl)Cl)C(=O)Cl"
          ]
        }
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