2,4-dichlorophenyl Benzenesulphonate
Everything that changed this flow. Back to the flow
6c20084a-8d6c-436d-86a2-4f7e81db7e7a
By field
13 fields| Field | Changes | Written by | Latest note |
|---|---|---|---|
| properties | 5 | enrich_references, normalise_property_values, opsin_iupac, rdkit_post_consensus, rdkit_pre_consensus | typed the way the ontology types it |
| altLabel | 2 | consensus_match, strip_catalogue_altlabels | Removed 5 catalogue altLabel value(s): 'EM 923' (grade code), 'Genite 923' (trade name), 'Genitol 923' (trade name), 'NSC 27323' (registry code), 'NSC 38761' (registry code) |
| prefLabel | 2 | bootstrap_labels, normalize_name_case | Title-cased words without internal capitals (preserved words with uppercase letters beyond the first character) |
| cas_match_labels | 1 | consensus_match | group_key=2,4-dichlorophenylbenzenesulphonate||dimension=Environmental > media=Air > strata=Ground level > population_density=Urban (>1000 people/square mile); group_sources=['ec_inventory', 'pubchem']; cas_sources={'97-16-5': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-16156ff6aa53cda1: {'97-16-5': 'exactMatch'} |
| concept_associations | 1 | carry_associations_onto_flows | associations resolved on the elementary layer |
| context | 1 | default_context_mapping | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to water > Emissions to sea water |
| context_iri | 1 | default_context_mapping | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to water > Emissions to sea water |
| name | 1 | bootstrap_labels | Purged legacy name field to enforce prefLabel usage |
| references | 1 | enrich_references | Added references with provenance; cas_numbers=['97-16-5']; matched_chebi_ids=[]; candidate_pubchem_cids=[7327, 240989]; selected_pubchem_cids=[7327]; formula_similarity_expected=[]; pubchem_selection_rule=curated_cas_then_formula_similarity_then_prefer_chebi_aligned_when_unambiguous_else_keep_all_cas_matches; single_cas_commonchem_link=yes |
| skos_definition | 1 | enrich_references | Merged ChEBI/PubChem definitions into skos:definition |
| synonyms | 1 | bootstrap_labels | Removed legacy synonyms field in favor of structured labels |
| types | 1 | link_flows_to_their_substance | the substance's answer, copied onto its flow |
| unit_iri | 1 | unit_normalization | Unit IRI set from normalization of 'kg' |
Where several steps wrote one field, the last one won — and the log below shows the sequence.
Changes
19| # | Step | Field | From | To | Why |
|---|---|---|---|---|---|
| 4,660 | bootstrap_labels | prefLabel | — | [{"@value":"2,4-dichlorophenyl benzenesulphonate","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","… | Bootstrapped prefLabel from legacy name field |
| 4,661 | bootstrap_labels | name | 2,4-dichlorophenyl benzenesulphonate | — | Purged legacy name field to enforce prefLabel usage |
| 4,662 | bootstrap_labels | synonyms | ["organic","2,4-dichlorophenylbenzenesulphonate"] | [] | Removed legacy synonyms field in favor of structured labels |
| 114,198 | default_context_mapping | context | — | {"dimension":"Environmental","media":"Water","water_body":"Ocean"} | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to water > Emissions to sea water |
| 114,199 | default_context_mapping | context_iri | — | https://vocab.brightway.one/flow-contexts/envi-wate-ocea | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to water > Emissions to sea water |
| 214,896 | unit_normalization | unit_iri | — | https://vocab.brightway.one/units/unit/KiloGM | Unit IRI set from normalization of 'kg' |
| 222,162 | normalize_name_case | prefLabel | [{"@value":"2,4-dichlorophenyl benzenesulphonate","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","… | [{"@value":"2,4-dichlorophenyl Benzenesulphonate","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","… | Title-cased words without internal capitals (preserved words with uppercase letters beyond the first character) |
| 231,660 | enrich_references | properties | {} | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C12H8Cl2O3… | Added ChEBI/PubChem properties (chebi_ids=0, pubchem_cids=1) |
| 231,661 | enrich_references | skos_definition | — | [] | Merged ChEBI/PubChem definitions into skos:definition |
| 231,662 | enrich_references | references | [] | [{"@id":"http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J4.944A","provenance":{"prov:wasGeneratedBy":"enrich_reference… | Added references with provenance; cas_numbers=['97-16-5']; matched_chebi_ids=[]; candidate_pubchem_cids=[7327, 240989]; selected_pubchem_cids=[7327]; formula_similarity_expected=[]; pubchem_selection_rule=curated_cas_then_formula_similarity_then_prefer_chebi_aligned_when_unambiguous_else_keep_all_cas_matches; single_cas_commonchem_link=yes |
| 249,605 | rdkit_pre_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C12H8Cl2O3… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C12H8Cl2O3… | rdkit_pre_consensus from 'C1=CC=C(C=C1)S(=O)(=O)OC2=C(C=C(C=C2)Cl)Cl'; added: molecular_mass, monoisotopic_mass |
| 259,942 | consensus_match | altLabel | [] | [{"@value":"2,4-Dichlorophenyl benzenesulfonate","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","pr… | group_key=2,4-dichlorophenylbenzenesulphonate||dimension=Environmental > media=Air > strata=Ground level > population_density=Urban (>1000 people/square mile); cas=97-16-5; added Common Chemistry CAS names as altLabel: 2,4-Dichlorophenyl benzenesulfonate, Benzenesulfonic acid, 2,4-dichlorophenyl ester, EM 923, Genit, Genite, Genite (insecticide), Genite 923, Genite EM 923, Genitol 923, NSC 27323, NSC 38761, Phenol, 2,4-dichloro-, 1-benzenesulfonate, Phenol, 2,4-dichloro-, benzenesulfonate; object_uuid=fo-16156ff6aa53cda1 |
| 259,943 | consensus_match | cas_match_labels | — | {"97-16-5":"exactMatch"} | group_key=2,4-dichlorophenylbenzenesulphonate||dimension=Environmental > media=Air > strata=Ground level > population_density=Urban (>1000 people/square mile); group_sources=['ec_inventory', 'pubchem']; cas_sources={'97-16-5': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-16156ff6aa53cda1: {'97-16-5': 'exactMatch'} |
| 274,735 | opsin_iupac | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C12H8Cl2O3… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C12H8Cl2O3… | opsin_iupac: set authoritative IUPAC name, SMILES, InChI from '2,4-dichlorophenyl Benzenesulphonate' |
| 281,196 | rdkit_post_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C12H8Cl2O3… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C12H8Cl2O3… | rdkit_post_consensus from 'O=S(=O)(Oc1ccc(Cl)cc1Cl)c1ccccc1'; confirmed: smiles_string, inchi2d_string, inchi2d_key_string, molecular_formula, molecular_mass, monoisotopic_mass |
| 288,199 | strip_catalogue_altlabels | altLabel | [{"@value":"2,4-Dichlorophenyl benzenesulfonate","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","pr… | [{"@value":"2,4-Dichlorophenyl benzenesulfonate","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","pr… | Removed 5 catalogue altLabel value(s): 'EM 923' (grade code), 'Genite 923' (trade name), 'Genitol 923' (trade name), 'NSC 27323' (registry code), 'NSC 38761' (registry code) |
| 338,091 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/6c20084a-8d6c-… | associations resolved on the elementary layer |
| 389,037 | normalise_property_values | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C12H8Cl2O3… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C12H8Cl2O3… | typed the way the ontology types it |
| 396,023 | link_flows_to_their_substance | types | — | ["https://w3id.org/chemrof/NeutralMolecule"] | the substance's answer, copied onto its flow |
PROV-O trail
19 activitiesOne activity per change: which version of the flow it consumed, and which it produced. The values are on the change with the same number — stored once, not twice.
| Activity | Field | Agent | Used | Generated |
|---|---|---|---|---|
| ef:activity/change/20260821T0609040591070000/4660 | prefLabel | ef:agent/bootstrap_labels | ef:flow/6c20084a-8d6c-436d-86a2-4f7e81db7e7a/v0 | ef:flow/6c20084a-8d6c-436d-86a2-4f7e81db7e7a/v1 |
| ef:activity/change/20260821T0609040591070000/4661 | name | ef:agent/bootstrap_labels | ef:flow/6c20084a-8d6c-436d-86a2-4f7e81db7e7a/v1 | ef:flow/6c20084a-8d6c-436d-86a2-4f7e81db7e7a/v2 |
| ef:activity/change/20260821T0609040591070000/4662 | synonyms | ef:agent/bootstrap_labels | ef:flow/6c20084a-8d6c-436d-86a2-4f7e81db7e7a/v2 | ef:flow/6c20084a-8d6c-436d-86a2-4f7e81db7e7a/v3 |
| ef:activity/change/20260821T0609040591070000/114198 | context | ef:agent/default_context_mapping | ef:flow/6c20084a-8d6c-436d-86a2-4f7e81db7e7a/v3 | ef:flow/6c20084a-8d6c-436d-86a2-4f7e81db7e7a/v4 |
| ef:activity/change/20260821T0609040591070000/114199 | context_iri | ef:agent/default_context_mapping | ef:flow/6c20084a-8d6c-436d-86a2-4f7e81db7e7a/v4 | ef:flow/6c20084a-8d6c-436d-86a2-4f7e81db7e7a/v5 |
| ef:activity/change/20260821T0609040591070000/214896 | unit_iri | ef:agent/unit_normalization | ef:flow/6c20084a-8d6c-436d-86a2-4f7e81db7e7a/v5 | ef:flow/6c20084a-8d6c-436d-86a2-4f7e81db7e7a/v6 |
| ef:activity/change/20260821T0609040591070000/222162 | prefLabel | ef:agent/normalize_name_case | ef:flow/6c20084a-8d6c-436d-86a2-4f7e81db7e7a/v6 | ef:flow/6c20084a-8d6c-436d-86a2-4f7e81db7e7a/v7 |
| ef:activity/change/20260821T0609040591070000/231660 | properties | ef:agent/enrich_references | ef:flow/6c20084a-8d6c-436d-86a2-4f7e81db7e7a/v7 | ef:flow/6c20084a-8d6c-436d-86a2-4f7e81db7e7a/v8 |
| ef:activity/change/20260821T0609040591070000/231661 | skos_definition | ef:agent/enrich_references | ef:flow/6c20084a-8d6c-436d-86a2-4f7e81db7e7a/v8 | ef:flow/6c20084a-8d6c-436d-86a2-4f7e81db7e7a/v9 |
| ef:activity/change/20260821T0609040591070000/231662 | references | ef:agent/enrich_references | ef:flow/6c20084a-8d6c-436d-86a2-4f7e81db7e7a/v9 | ef:flow/6c20084a-8d6c-436d-86a2-4f7e81db7e7a/v10 |
| ef:activity/change/20260821T0609040591070000/249605 | properties | ef:agent/rdkit_pre_consensus | ef:flow/6c20084a-8d6c-436d-86a2-4f7e81db7e7a/v10 | ef:flow/6c20084a-8d6c-436d-86a2-4f7e81db7e7a/v11 |
| ef:activity/change/20260821T0609040591070000/259942 | altLabel | ef:agent/consensus_match | ef:flow/6c20084a-8d6c-436d-86a2-4f7e81db7e7a/v11 | ef:flow/6c20084a-8d6c-436d-86a2-4f7e81db7e7a/v12 |
| ef:activity/change/20260821T0609040591070000/259943 | cas_match_labels | ef:agent/consensus_match | ef:flow/6c20084a-8d6c-436d-86a2-4f7e81db7e7a/v12 | ef:flow/6c20084a-8d6c-436d-86a2-4f7e81db7e7a/v13 |
| ef:activity/change/20260821T0609040591070000/274735 | properties | ef:agent/opsin_iupac | ef:flow/6c20084a-8d6c-436d-86a2-4f7e81db7e7a/v13 | ef:flow/6c20084a-8d6c-436d-86a2-4f7e81db7e7a/v14 |
| ef:activity/change/20260821T0609040591070000/281196 | properties | ef:agent/rdkit_post_consensus | ef:flow/6c20084a-8d6c-436d-86a2-4f7e81db7e7a/v14 | ef:flow/6c20084a-8d6c-436d-86a2-4f7e81db7e7a/v15 |
| ef:activity/change/20260821T0609040591070000/288199 | altLabel | ef:agent/strip_catalogue_altlabels | ef:flow/6c20084a-8d6c-436d-86a2-4f7e81db7e7a/v15 | ef:flow/6c20084a-8d6c-436d-86a2-4f7e81db7e7a/v16 |
| ef:activity/change/20260821T0609040591070000/338091 | concept_associations | ef:agent/carry_associations_onto_flows | ef:flow/6c20084a-8d6c-436d-86a2-4f7e81db7e7a/v16 | ef:flow/6c20084a-8d6c-436d-86a2-4f7e81db7e7a/v17 |
| ef:activity/change/20260821T0609040591070000/389037 | properties | ef:agent/normalise_property_values | ef:flow/6c20084a-8d6c-436d-86a2-4f7e81db7e7a/v17 | ef:flow/6c20084a-8d6c-436d-86a2-4f7e81db7e7a/v18 |
| ef:activity/change/20260821T0609040591070000/396023 | types | ef:agent/link_flows_to_their_substance | ef:flow/6c20084a-8d6c-436d-86a2-4f7e81db7e7a/v18 | ef:flow/6c20084a-8d6c-436d-86a2-4f7e81db7e7a/v19 |