2-methoxy-4-(trifluoromethyl)pyridine
Everything that changed this flow. Back to the flow
6f12371c-50c8-4f1d-ad00-f9fbf86a3b1e
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=2-methoxy-4-(trifluoromethyl)pyridine||dimension=Environmental > media=Ground > geography=Agricultural; cas=219715-34-1; added Common Chemistry CAS names as altLabel: Pyridine, 2-methoxy-4-(trifluoromethyl)-; object_uuid=fo-cb0a5954d4525908 |
| cas_match_labels | 1 | consensus_match | group_key=2-methoxy-4-(trifluoromethyl)pyridine||dimension=Environmental > media=Ground > geography=Agricultural; group_sources=['pubchem']; cas_sources={'219715-34-1': ['pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-cb0a5954d4525908: {'219715-34-1': '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 water > Emissions to fresh water |
| context_iri | 1 | default_context_mapping | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to water > Emissions to fresh water |
| 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=['219715-34-1']; matched_chebi_ids=[]; candidate_pubchem_cids=[18539797]; selected_pubchem_cids=[18539797]; 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 |
|---|---|---|---|---|---|
| 12,429 | bootstrap_labels | prefLabel | — | [{"@value":"2-methoxy-4-(trifluoromethyl)pyridine","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels",… | Bootstrapped prefLabel from legacy name field |
| 12,430 | bootstrap_labels | name | 2-methoxy-4-(trifluoromethyl)pyridine | — | Purged legacy name field to enforce prefLabel usage |
| 12,431 | bootstrap_labels | synonyms | ["organic","pyridine,2-methoxy-4-(trifluoromethyl)-","m-tmpothernames2-methoxy-3-chlorosulfonyl-4-trifluoromethylpyridi… | [] | Removed legacy synonyms field in favor of structured labels |
| 115,946 | default_context_mapping | context | — | {"dimension":"Environmental","media":"Water","water_body":"Surface water"} | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to water > Emissions to fresh water |
| 115,947 | default_context_mapping | context_iri | — | https://vocab.brightway.one/flow-contexts/envi-wate-suwa | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to water > Emissions to fresh water |
| 217,452 | unit_normalization | unit_iri | — | https://vocab.brightway.one/units/unit/KiloGM | Unit IRI set from normalization of 'kg' |
| 238,987 | enrich_references | properties | {} | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C7H6F3NO"]… | Added ChEBI/PubChem properties (chebi_ids=0, pubchem_cids=1) |
| 238,988 | enrich_references | skos_definition | — | [] | Merged ChEBI/PubChem definitions into skos:definition |
| 238,989 | enrich_references | references | [] | [{"@id":"https://chem.echa.europa.eu/100.121.578","provenance":{"prov:wasGeneratedBy":"enrich_references.pubchem_identi… | Added references with provenance; cas_numbers=['219715-34-1']; matched_chebi_ids=[]; candidate_pubchem_cids=[18539797]; selected_pubchem_cids=[18539797]; 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 |
| 251,711 | rdkit_pre_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C7H6F3NO"]… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C7H6F3NO"]… | rdkit_pre_consensus from 'COC1=NC=CC(=C1)C(F)(F)F'; added: molecular_mass, monoisotopic_mass |
| 260,993 | consensus_match | altLabel | [] | [{"@value":"Pyridine, 2-methoxy-4-(trifluoromethyl)-","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match… | group_key=2-methoxy-4-(trifluoromethyl)pyridine||dimension=Environmental > media=Ground > geography=Agricultural; cas=219715-34-1; added Common Chemistry CAS names as altLabel: Pyridine, 2-methoxy-4-(trifluoromethyl)-; object_uuid=fo-cb0a5954d4525908 |
| 260,994 | consensus_match | cas_match_labels | — | {"219715-34-1":"exactMatch"} | group_key=2-methoxy-4-(trifluoromethyl)pyridine||dimension=Environmental > media=Ground > geography=Agricultural; group_sources=['pubchem']; cas_sources={'219715-34-1': ['pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-cb0a5954d4525908: {'219715-34-1': 'exactMatch'} |
| 276,896 | opsin_iupac | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C7H6F3NO"]… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C7H6F3NO"]… | opsin_iupac: set authoritative IUPAC name, SMILES, InChI from '2-methoxy-4-(trifluoromethyl)pyridine' |
| 283,543 | rdkit_post_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C7H6F3NO"]… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C7H6F3NO"]… | rdkit_post_consensus from 'COc1cc(C(F)(F)F)ccn1'; confirmed: smiles_string, inchi2d_string, inchi2d_key_string, molecular_formula, molecular_mass, monoisotopic_mass |
| 338,972 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/6f12371c-50c8-… | associations resolved on the elementary layer |
| 391,253 | normalise_property_values | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C7H6F3NO"]… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C7H6F3NO"]… | typed the way the ontology types it |
| 399,202 | 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/20260821T1302361922970000/12429 | prefLabel | ef:agent/bootstrap_labels | ef:flow/6f12371c-50c8-4f1d-ad00-f9fbf86a3b1e/v0 | ef:flow/6f12371c-50c8-4f1d-ad00-f9fbf86a3b1e/v1 |
| ef:activity/change/20260821T1302361922970000/12430 | name | ef:agent/bootstrap_labels | ef:flow/6f12371c-50c8-4f1d-ad00-f9fbf86a3b1e/v1 | ef:flow/6f12371c-50c8-4f1d-ad00-f9fbf86a3b1e/v2 |
| ef:activity/change/20260821T1302361922970000/12431 | synonyms | ef:agent/bootstrap_labels | ef:flow/6f12371c-50c8-4f1d-ad00-f9fbf86a3b1e/v2 | ef:flow/6f12371c-50c8-4f1d-ad00-f9fbf86a3b1e/v3 |
| ef:activity/change/20260821T1302361922970000/115946 | context | ef:agent/default_context_mapping | ef:flow/6f12371c-50c8-4f1d-ad00-f9fbf86a3b1e/v3 | ef:flow/6f12371c-50c8-4f1d-ad00-f9fbf86a3b1e/v4 |
| ef:activity/change/20260821T1302361922970000/115947 | context_iri | ef:agent/default_context_mapping | ef:flow/6f12371c-50c8-4f1d-ad00-f9fbf86a3b1e/v4 | ef:flow/6f12371c-50c8-4f1d-ad00-f9fbf86a3b1e/v5 |
| ef:activity/change/20260821T1302361922970000/217452 | unit_iri | ef:agent/unit_normalization | ef:flow/6f12371c-50c8-4f1d-ad00-f9fbf86a3b1e/v5 | ef:flow/6f12371c-50c8-4f1d-ad00-f9fbf86a3b1e/v6 |
| ef:activity/change/20260821T1302361922970000/238987 | properties | ef:agent/enrich_references | ef:flow/6f12371c-50c8-4f1d-ad00-f9fbf86a3b1e/v6 | ef:flow/6f12371c-50c8-4f1d-ad00-f9fbf86a3b1e/v7 |
| ef:activity/change/20260821T1302361922970000/238988 | skos_definition | ef:agent/enrich_references | ef:flow/6f12371c-50c8-4f1d-ad00-f9fbf86a3b1e/v7 | ef:flow/6f12371c-50c8-4f1d-ad00-f9fbf86a3b1e/v8 |
| ef:activity/change/20260821T1302361922970000/238989 | references | ef:agent/enrich_references | ef:flow/6f12371c-50c8-4f1d-ad00-f9fbf86a3b1e/v8 | ef:flow/6f12371c-50c8-4f1d-ad00-f9fbf86a3b1e/v9 |
| ef:activity/change/20260821T1302361922970000/251711 | properties | ef:agent/rdkit_pre_consensus | ef:flow/6f12371c-50c8-4f1d-ad00-f9fbf86a3b1e/v9 | ef:flow/6f12371c-50c8-4f1d-ad00-f9fbf86a3b1e/v10 |
| ef:activity/change/20260821T1302361922970000/260993 | altLabel | ef:agent/consensus_match | ef:flow/6f12371c-50c8-4f1d-ad00-f9fbf86a3b1e/v10 | ef:flow/6f12371c-50c8-4f1d-ad00-f9fbf86a3b1e/v11 |
| ef:activity/change/20260821T1302361922970000/260994 | cas_match_labels | ef:agent/consensus_match | ef:flow/6f12371c-50c8-4f1d-ad00-f9fbf86a3b1e/v11 | ef:flow/6f12371c-50c8-4f1d-ad00-f9fbf86a3b1e/v12 |
| ef:activity/change/20260821T1302361922970000/276896 | properties | ef:agent/opsin_iupac | ef:flow/6f12371c-50c8-4f1d-ad00-f9fbf86a3b1e/v12 | ef:flow/6f12371c-50c8-4f1d-ad00-f9fbf86a3b1e/v13 |
| ef:activity/change/20260821T1302361922970000/283543 | properties | ef:agent/rdkit_post_consensus | ef:flow/6f12371c-50c8-4f1d-ad00-f9fbf86a3b1e/v13 | ef:flow/6f12371c-50c8-4f1d-ad00-f9fbf86a3b1e/v14 |
| ef:activity/change/20260821T1302361922970000/338972 | concept_associations | ef:agent/carry_associations_onto_flows | ef:flow/6f12371c-50c8-4f1d-ad00-f9fbf86a3b1e/v14 | ef:flow/6f12371c-50c8-4f1d-ad00-f9fbf86a3b1e/v15 |
| ef:activity/change/20260821T1302361922970000/391253 | properties | ef:agent/normalise_property_values | ef:flow/6f12371c-50c8-4f1d-ad00-f9fbf86a3b1e/v15 | ef:flow/6f12371c-50c8-4f1d-ad00-f9fbf86a3b1e/v16 |
| ef:activity/change/20260821T1302361922970000/399202 | types | ef:agent/link_flows_to_their_substance | ef:flow/6f12371c-50c8-4f1d-ad00-f9fbf86a3b1e/v16 | ef:flow/6f12371c-50c8-4f1d-ad00-f9fbf86a3b1e/v17 |