3,4-dichloroaniline
Everything that changed this flow. Back to the flow
4d9a8790-3ddd-11dd-9af9-0050c2490048
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 | 3 | chebi_altlabels, consensus_match, strip_catalogue_altlabels | Removed 1 catalogue altLabel value(s): 'NSC 247' (registry code) |
| cas_match_labels | 1 | consensus_match | group_key=3,4-dichloroaniline||dimension=Environmental > media=Water > water_body=Long-term; group_sources=['chebi', 'ec_inventory', 'pubchem']; cas_sources={'95-76-1': ['chebi', 'ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-500eb5a6a75a52ab: {'95-76-1': '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 soil > Emissions to soil, unspecified |
| context_iri | 1 | default_context_mapping | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to soil > Emissions to soil, unspecified |
| name | 1 | bootstrap_labels | Purged legacy name field to enforce prefLabel usage |
| prefLabel | 1 | bootstrap_labels | Bootstrapped prefLabel from legacy name field |
| references | 1 | enrich_references | Added references with provenance; cas_numbers=['95-76-1']; matched_chebi_ids=['http://purl.obolibrary.org/obo/CHEBI_16767']; candidate_pubchem_cids=[7257, 194519]; selected_pubchem_cids=[7257]; 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 |
|---|---|---|---|---|---|
| 22,703 | bootstrap_labels | prefLabel | — | [{"@value":"3,4-dichloroaniline","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:wasAttribute… | Bootstrapped prefLabel from legacy name field |
| 22,704 | bootstrap_labels | name | 3,4-dichloroaniline | — | Purged legacy name field to enforce prefLabel usage |
| 22,705 | bootstrap_labels | synonyms | ["(amine)","060395","1-Amino-3,4-dichlorobenzene","3,4 dichloro aniline","3,4-DCA","3,4-Dichloranilin","3,4-Dichloranil… | [] | Removed legacy synonyms field in favor of structured labels |
| 94,608 | default_context_mapping | context | — | {"dimension":"Environmental","media":"Ground","geography":"Unknown"} | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to soil > Emissions to soil, unspecified |
| 94,609 | default_context_mapping | context_iri | — | https://vocab.brightway.one/flow-contexts/envi-grou-unkn | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to soil > Emissions to soil, unspecified |
| 220,533 | unit_normalization | unit_iri | — | https://vocab.brightway.one/units/unit/KiloGM | Unit IRI set from normalization of 'kg' |
| 247,612 | enrich_references | properties | {} | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C6H5Cl2N"]… | Added ChEBI/PubChem properties (chebi_ids=1, pubchem_cids=1) |
| 247,613 | enrich_references | skos_definition | — | [{"@value":"A dichloroaniline having the two chloro-substituents at the 3- and 4-positions.","@language":"en","provenan… | Merged ChEBI/PubChem definitions into skos:definition |
| 247,614 | enrich_references | references | [] | [{"@id":"beilstein:636837","provenance":{"prov:wasGeneratedBy":"enrich_references.chebi_xrefs","prov:wasAttributedTo":"… | Added references with provenance; cas_numbers=['95-76-1']; matched_chebi_ids=['http://purl.obolibrary.org/obo/CHEBI_16767']; candidate_pubchem_cids=[7257, 194519]; selected_pubchem_cids=[7257]; 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 |
| 254,212 | rdkit_pre_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C6H5Cl2N"]… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C6H5Cl2N"]… | rdkit_pre_consensus from 'C1=CC(=C(C=C1N)Cl)Cl'; added: monoisotopic_mass |
| 257,245 | chebi_altlabels | altLabel | [] | [{"@value":"1-amino-3,4-dichlorobenzene","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov:wasAt… | Added 7 ChEBI synonym(s) as altLabel from 1 linked ChEBI record(s) |
| 261,528 | consensus_match | altLabel | [{"@value":"1-amino-3,4-dichlorobenzene","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov:wasAt… | [{"@value":"1-amino-3,4-dichlorobenzene","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov:wasAt… | group_key=3,4-dichloroaniline||dimension=Environmental > media=Water > water_body=Long-term; cas=95-76-1; added Common Chemistry CAS names as altLabel: 3,4-Dichlorophenylamine, 4-Amino-1,2-dichlorobenzene, Aniline, 3,4-dichloro-, Benzenamine, 3,4-dichloro-, DCA, DCA (amine), LY 004892, NSC 247; object_uuid=fo-500eb5a6a75a52ab |
| 261,529 | consensus_match | cas_match_labels | — | {"95-76-1":"exactMatch"} | group_key=3,4-dichloroaniline||dimension=Environmental > media=Water > water_body=Long-term; group_sources=['chebi', 'ec_inventory', 'pubchem']; cas_sources={'95-76-1': ['chebi', 'ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-500eb5a6a75a52ab: {'95-76-1': 'exactMatch'} |
| 279,430 | opsin_iupac | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C6H5Cl2N"]… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C6H5Cl2N"]… | opsin_iupac: set authoritative IUPAC name, SMILES, InChI from '3,4-dichloroaniline' |
| 286,306 | rdkit_post_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C6H5Cl2N"]… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C6H5Cl2N"]… | rdkit_post_consensus from 'Nc1ccc(Cl)c(Cl)c1'; confirmed: smiles_string, inchi2d_string, inchi2d_key_string, molecular_formula, molecular_mass, monoisotopic_mass |
| 291,660 | strip_catalogue_altlabels | altLabel | [{"@value":"1-amino-3,4-dichlorobenzene","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov:wasAt… | [{"@value":"1-amino-3,4-dichlorobenzene","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov:wasAt… | Removed 1 catalogue altLabel value(s): 'NSC 247' (registry code) |
| 328,302 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/4d9a8790-3ddd-… | associations resolved on the elementary layer |
| 393,823 | normalise_property_values | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C6H5Cl2N"]… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C6H5Cl2N"]… | typed the way the ontology types it |
| 403,014 | 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/20260821T1554374006150000/22703 | prefLabel | ef:agent/bootstrap_labels | ef:flow/4d9a8790-3ddd-11dd-9af9-0050c2490048/v0 | ef:flow/4d9a8790-3ddd-11dd-9af9-0050c2490048/v1 |
| ef:activity/change/20260821T1554374006150000/22704 | name | ef:agent/bootstrap_labels | ef:flow/4d9a8790-3ddd-11dd-9af9-0050c2490048/v1 | ef:flow/4d9a8790-3ddd-11dd-9af9-0050c2490048/v2 |
| ef:activity/change/20260821T1554374006150000/22705 | synonyms | ef:agent/bootstrap_labels | ef:flow/4d9a8790-3ddd-11dd-9af9-0050c2490048/v2 | ef:flow/4d9a8790-3ddd-11dd-9af9-0050c2490048/v3 |
| ef:activity/change/20260821T1554374006150000/94608 | context | ef:agent/default_context_mapping | ef:flow/4d9a8790-3ddd-11dd-9af9-0050c2490048/v3 | ef:flow/4d9a8790-3ddd-11dd-9af9-0050c2490048/v4 |
| ef:activity/change/20260821T1554374006150000/94609 | context_iri | ef:agent/default_context_mapping | ef:flow/4d9a8790-3ddd-11dd-9af9-0050c2490048/v4 | ef:flow/4d9a8790-3ddd-11dd-9af9-0050c2490048/v5 |
| ef:activity/change/20260821T1554374006150000/220533 | unit_iri | ef:agent/unit_normalization | ef:flow/4d9a8790-3ddd-11dd-9af9-0050c2490048/v5 | ef:flow/4d9a8790-3ddd-11dd-9af9-0050c2490048/v6 |
| ef:activity/change/20260821T1554374006150000/247612 | properties | ef:agent/enrich_references | ef:flow/4d9a8790-3ddd-11dd-9af9-0050c2490048/v6 | ef:flow/4d9a8790-3ddd-11dd-9af9-0050c2490048/v7 |
| ef:activity/change/20260821T1554374006150000/247613 | skos_definition | ef:agent/enrich_references | ef:flow/4d9a8790-3ddd-11dd-9af9-0050c2490048/v7 | ef:flow/4d9a8790-3ddd-11dd-9af9-0050c2490048/v8 |
| ef:activity/change/20260821T1554374006150000/247614 | references | ef:agent/enrich_references | ef:flow/4d9a8790-3ddd-11dd-9af9-0050c2490048/v8 | ef:flow/4d9a8790-3ddd-11dd-9af9-0050c2490048/v9 |
| ef:activity/change/20260821T1554374006150000/254212 | properties | ef:agent/rdkit_pre_consensus | ef:flow/4d9a8790-3ddd-11dd-9af9-0050c2490048/v9 | ef:flow/4d9a8790-3ddd-11dd-9af9-0050c2490048/v10 |
| ef:activity/change/20260821T1554374006150000/257245 | altLabel | ef:agent/chebi_altlabels | ef:flow/4d9a8790-3ddd-11dd-9af9-0050c2490048/v10 | ef:flow/4d9a8790-3ddd-11dd-9af9-0050c2490048/v11 |
| ef:activity/change/20260821T1554374006150000/261528 | altLabel | ef:agent/consensus_match | ef:flow/4d9a8790-3ddd-11dd-9af9-0050c2490048/v11 | ef:flow/4d9a8790-3ddd-11dd-9af9-0050c2490048/v12 |
| ef:activity/change/20260821T1554374006150000/261529 | cas_match_labels | ef:agent/consensus_match | ef:flow/4d9a8790-3ddd-11dd-9af9-0050c2490048/v12 | ef:flow/4d9a8790-3ddd-11dd-9af9-0050c2490048/v13 |
| ef:activity/change/20260821T1554374006150000/279430 | properties | ef:agent/opsin_iupac | ef:flow/4d9a8790-3ddd-11dd-9af9-0050c2490048/v13 | ef:flow/4d9a8790-3ddd-11dd-9af9-0050c2490048/v14 |
| ef:activity/change/20260821T1554374006150000/286306 | properties | ef:agent/rdkit_post_consensus | ef:flow/4d9a8790-3ddd-11dd-9af9-0050c2490048/v14 | ef:flow/4d9a8790-3ddd-11dd-9af9-0050c2490048/v15 |
| ef:activity/change/20260821T1554374006150000/291660 | altLabel | ef:agent/strip_catalogue_altlabels | ef:flow/4d9a8790-3ddd-11dd-9af9-0050c2490048/v15 | ef:flow/4d9a8790-3ddd-11dd-9af9-0050c2490048/v16 |
| ef:activity/change/20260821T1554374006150000/328302 | concept_associations | ef:agent/carry_associations_onto_flows | ef:flow/4d9a8790-3ddd-11dd-9af9-0050c2490048/v16 | ef:flow/4d9a8790-3ddd-11dd-9af9-0050c2490048/v17 |
| ef:activity/change/20260821T1554374006150000/393823 | properties | ef:agent/normalise_property_values | ef:flow/4d9a8790-3ddd-11dd-9af9-0050c2490048/v17 | ef:flow/4d9a8790-3ddd-11dd-9af9-0050c2490048/v18 |
| ef:activity/change/20260821T1554374006150000/403014 | types | ef:agent/link_flows_to_their_substance | ef:flow/4d9a8790-3ddd-11dd-9af9-0050c2490048/v18 | ef:flow/4d9a8790-3ddd-11dd-9af9-0050c2490048/v19 |