3,4-dichlorobenzonitrile
Everything that changed this flow. Back to the flow
517fecb8-1fe0-4aa4-ae8e-9200a61354a8
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 | 1 | consensus_match | group_key=3,4-dichlorobenzonitrile||dimension=Environmental > media=Air > strata=Medium stack, <150 meters > population_density=Rural (<1000 people/square mile); cas=6574-99-8; added Common Chemistry CAS names as altLabel: Benzonitrile, 3,4-dichloro-; object_uuid=fo-6241f9f0909b1dcb |
| cas_match_labels | 1 | consensus_match | group_key=3,4-dichlorobenzonitrile||dimension=Environmental > media=Air > strata=Medium stack, <150 meters > population_density=Rural (<1000 people/square mile); group_sources=['ec_inventory', 'pubchem']; cas_sources={'6574-99-8': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-6241f9f0909b1dcb: {'6574-99-8': '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 agricultural soil |
| context_iri | 1 | default_context_mapping | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to soil > Emissions to agricultural soil |
| 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=['6574-99-8']; matched_chebi_ids=[]; candidate_pubchem_cids=[81051, 259626]; selected_pubchem_cids=[81051]; 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
17| # | Step | Field | From | To | Why |
|---|---|---|---|---|---|
| 12,183 | bootstrap_labels | prefLabel | — | [{"@value":"3,4-dichlorobenzonitrile","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:wasAttr… | Bootstrapped prefLabel from legacy name field |
| 12,184 | bootstrap_labels | name | 3,4-dichlorobenzonitrile | — | Purged legacy name field to enforce prefLabel usage |
| 12,185 | bootstrap_labels | synonyms | ["organic","3,4-dichlorobenzonitrile","34dcbn"] | [] | Removed legacy synonyms field in favor of structured labels |
| 98,366 | default_context_mapping | context | — | {"dimension":"Environmental","media":"Ground","geography":"Agricultural"} | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to soil > Emissions to agricultural soil |
| 98,367 | default_context_mapping | context_iri | — | https://vocab.brightway.one/flow-contexts/envi-grou-agri | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to soil > Emissions to agricultural soil |
| 217,374 | unit_normalization | unit_iri | — | https://vocab.brightway.one/units/unit/KiloGM | Unit IRI set from normalization of 'kg' |
| 238,763 | enrich_references | properties | {} | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C7H3Cl2N"]… | Added ChEBI/PubChem properties (chebi_ids=0, pubchem_cids=1) |
| 238,764 | enrich_references | skos_definition | — | [] | Merged ChEBI/PubChem definitions into skos:definition |
| 238,765 | enrich_references | references | [] | [{"@id":"http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J225.195G","provenance":{"prov:wasGeneratedBy":"enrich_referen… | Added references with provenance; cas_numbers=['6574-99-8']; matched_chebi_ids=[]; candidate_pubchem_cids=[81051, 259626]; selected_pubchem_cids=[81051]; 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 |
| 251,645 | rdkit_pre_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C7H3Cl2N"]… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C7H3Cl2N"]… | rdkit_pre_consensus from 'C1=CC(=C(C=C1C#N)Cl)Cl'; added: molecular_mass, monoisotopic_mass |
| 261,530 | consensus_match | altLabel | [] | [{"@value":"Benzonitrile, 3,4-dichloro-","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAt… | group_key=3,4-dichlorobenzonitrile||dimension=Environmental > media=Air > strata=Medium stack, <150 meters > population_density=Rural (<1000 people/square mile); cas=6574-99-8; added Common Chemistry CAS names as altLabel: Benzonitrile, 3,4-dichloro-; object_uuid=fo-6241f9f0909b1dcb |
| 261,531 | consensus_match | cas_match_labels | — | {"6574-99-8":"exactMatch"} | group_key=3,4-dichlorobenzonitrile||dimension=Environmental > media=Air > strata=Medium stack, <150 meters > population_density=Rural (<1000 people/square mile); group_sources=['ec_inventory', 'pubchem']; cas_sources={'6574-99-8': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-6241f9f0909b1dcb: {'6574-99-8': 'exactMatch'} |
| 276,826 | opsin_iupac | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C7H3Cl2N"]… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C7H3Cl2N"]… | opsin_iupac: set authoritative IUPAC name, SMILES, InChI from '3,4-dichlorobenzonitrile' |
| 283,470 | rdkit_post_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C7H3Cl2N"]… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C7H3Cl2N"]… | rdkit_post_consensus from 'N#Cc1ccc(Cl)c(Cl)c1'; confirmed: smiles_string, inchi2d_string, inchi2d_key_string, molecular_formula, molecular_mass, monoisotopic_mass |
| 330,180 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/517fecb8-1fe0-… | associations resolved on the elementary layer |
| 391,184 | normalise_property_values | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C7H3Cl2N"]… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C7H3Cl2N"]… | typed the way the ontology types it |
| 399,109 | link_flows_to_their_substance | types | — | ["https://w3id.org/chemrof/NeutralMolecule"] | the substance's answer, copied onto its flow |
PROV-O trail
17 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/20260821T1554374006150000/12183 | prefLabel | ef:agent/bootstrap_labels | ef:flow/517fecb8-1fe0-4aa4-ae8e-9200a61354a8/v0 | ef:flow/517fecb8-1fe0-4aa4-ae8e-9200a61354a8/v1 |
| ef:activity/change/20260821T1554374006150000/12184 | name | ef:agent/bootstrap_labels | ef:flow/517fecb8-1fe0-4aa4-ae8e-9200a61354a8/v1 | ef:flow/517fecb8-1fe0-4aa4-ae8e-9200a61354a8/v2 |
| ef:activity/change/20260821T1554374006150000/12185 | synonyms | ef:agent/bootstrap_labels | ef:flow/517fecb8-1fe0-4aa4-ae8e-9200a61354a8/v2 | ef:flow/517fecb8-1fe0-4aa4-ae8e-9200a61354a8/v3 |
| ef:activity/change/20260821T1554374006150000/98366 | context | ef:agent/default_context_mapping | ef:flow/517fecb8-1fe0-4aa4-ae8e-9200a61354a8/v3 | ef:flow/517fecb8-1fe0-4aa4-ae8e-9200a61354a8/v4 |
| ef:activity/change/20260821T1554374006150000/98367 | context_iri | ef:agent/default_context_mapping | ef:flow/517fecb8-1fe0-4aa4-ae8e-9200a61354a8/v4 | ef:flow/517fecb8-1fe0-4aa4-ae8e-9200a61354a8/v5 |
| ef:activity/change/20260821T1554374006150000/217374 | unit_iri | ef:agent/unit_normalization | ef:flow/517fecb8-1fe0-4aa4-ae8e-9200a61354a8/v5 | ef:flow/517fecb8-1fe0-4aa4-ae8e-9200a61354a8/v6 |
| ef:activity/change/20260821T1554374006150000/238763 | properties | ef:agent/enrich_references | ef:flow/517fecb8-1fe0-4aa4-ae8e-9200a61354a8/v6 | ef:flow/517fecb8-1fe0-4aa4-ae8e-9200a61354a8/v7 |
| ef:activity/change/20260821T1554374006150000/238764 | skos_definition | ef:agent/enrich_references | ef:flow/517fecb8-1fe0-4aa4-ae8e-9200a61354a8/v7 | ef:flow/517fecb8-1fe0-4aa4-ae8e-9200a61354a8/v8 |
| ef:activity/change/20260821T1554374006150000/238765 | references | ef:agent/enrich_references | ef:flow/517fecb8-1fe0-4aa4-ae8e-9200a61354a8/v8 | ef:flow/517fecb8-1fe0-4aa4-ae8e-9200a61354a8/v9 |
| ef:activity/change/20260821T1554374006150000/251645 | properties | ef:agent/rdkit_pre_consensus | ef:flow/517fecb8-1fe0-4aa4-ae8e-9200a61354a8/v9 | ef:flow/517fecb8-1fe0-4aa4-ae8e-9200a61354a8/v10 |
| ef:activity/change/20260821T1554374006150000/261530 | altLabel | ef:agent/consensus_match | ef:flow/517fecb8-1fe0-4aa4-ae8e-9200a61354a8/v10 | ef:flow/517fecb8-1fe0-4aa4-ae8e-9200a61354a8/v11 |
| ef:activity/change/20260821T1554374006150000/261531 | cas_match_labels | ef:agent/consensus_match | ef:flow/517fecb8-1fe0-4aa4-ae8e-9200a61354a8/v11 | ef:flow/517fecb8-1fe0-4aa4-ae8e-9200a61354a8/v12 |
| ef:activity/change/20260821T1554374006150000/276826 | properties | ef:agent/opsin_iupac | ef:flow/517fecb8-1fe0-4aa4-ae8e-9200a61354a8/v12 | ef:flow/517fecb8-1fe0-4aa4-ae8e-9200a61354a8/v13 |
| ef:activity/change/20260821T1554374006150000/283470 | properties | ef:agent/rdkit_post_consensus | ef:flow/517fecb8-1fe0-4aa4-ae8e-9200a61354a8/v13 | ef:flow/517fecb8-1fe0-4aa4-ae8e-9200a61354a8/v14 |
| ef:activity/change/20260821T1554374006150000/330180 | concept_associations | ef:agent/carry_associations_onto_flows | ef:flow/517fecb8-1fe0-4aa4-ae8e-9200a61354a8/v14 | ef:flow/517fecb8-1fe0-4aa4-ae8e-9200a61354a8/v15 |
| ef:activity/change/20260821T1554374006150000/391184 | properties | ef:agent/normalise_property_values | ef:flow/517fecb8-1fe0-4aa4-ae8e-9200a61354a8/v15 | ef:flow/517fecb8-1fe0-4aa4-ae8e-9200a61354a8/v16 |
| ef:activity/change/20260821T1554374006150000/399109 | types | ef:agent/link_flows_to_their_substance | ef:flow/517fecb8-1fe0-4aa4-ae8e-9200a61354a8/v16 | ef:flow/517fecb8-1fe0-4aa4-ae8e-9200a61354a8/v17 |