3-(difluoromethyl)-1-methyl-1h-pyrazole-4-carboxylic Acid
Everything that changed this flow. Back to the flow
73210f98-f5eb-4bf1-a86a-db94a396d6fd
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, dedupe_altlabels | Deduplicated altLabel values and removed entries matching prefLabel |
| 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=3-(difluoromethyl)-1-methyl-1h-pyrazole-4-carboxylicacid||dimension=Environmental > media=Air > strata=Unknown; group_sources=['pubchem']; cas_sources={'176969-34-9': ['pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-e76296535832dda7: {'176969-34-9': '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 |
| references | 1 | enrich_references | Added references with provenance; cas_numbers=['176969-34-9']; matched_chebi_ids=[]; candidate_pubchem_cids=[18983008]; selected_pubchem_cids=[18983008]; 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 |
|---|---|---|---|---|---|
| 1,146 | bootstrap_labels | prefLabel | — | [{"@value":"3-(difluoromethyl)-1-methyl-1h-pyrazole-4-carboxylic acid","@language":"en","source":{"prov:wasGeneratedBy"… | Bootstrapped prefLabel from legacy name field |
| 1,147 | bootstrap_labels | name | 3-(difluoromethyl)-1-methyl-1h-pyrazole-4-carboxylic acid | — | Purged legacy name field to enforce prefLabel usage |
| 1,148 | bootstrap_labels | synonyms | ["organic"] | [] | Removed legacy synonyms field in favor of structured labels |
| 118,318 | 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 |
| 118,319 | 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 |
| 213,717 | unit_normalization | unit_iri | — | https://vocab.brightway.one/units/unit/KiloGM | Unit IRI set from normalization of 'kg' |
| 221,356 | normalize_name_case | prefLabel | [{"@value":"3-(difluoromethyl)-1-methyl-1h-pyrazole-4-carboxylic acid","@language":"en","source":{"prov:wasGeneratedBy"… | [{"@value":"3-(difluoromethyl)-1-methyl-1h-pyrazole-4-carboxylic Acid","@language":"en","source":{"prov:wasGeneratedBy"… | Title-cased words without internal capitals (preserved words with uppercase letters beyond the first character) |
| 228,273 | enrich_references | properties | {} | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C6H6F2N2O2… | Added ChEBI/PubChem properties (chebi_ids=0, pubchem_cids=1) |
| 228,274 | enrich_references | skos_definition | — | [] | Merged ChEBI/PubChem definitions into skos:definition |
| 228,275 | enrich_references | references | [] | [{"@id":"http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J2.629.165H","provenance":{"prov:wasGeneratedBy":"enrich_refer… | Added references with provenance; cas_numbers=['176969-34-9']; matched_chebi_ids=[]; candidate_pubchem_cids=[18983008]; selected_pubchem_cids=[18983008]; 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 |
| 248,628 | rdkit_pre_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C6H6F2N2O2… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C6H6F2N2O2… | rdkit_pre_consensus from 'CN1C=C(C(=N1)C(F)F)C(=O)O'; added: molecular_mass, monoisotopic_mass |
| 261,785 | consensus_match | altLabel | [] | [{"@value":"1-Methyl-3-(difluoromethyl)-1<em>H</em>-pyrazole-4-carboxylic acid","@language":"en","source":{"prov:wasGen… | group_key=3-(difluoromethyl)-1-methyl-1h-pyrazole-4-carboxylicacid||dimension=Environmental > media=Air > strata=Unknown; cas=176969-34-9; added Common Chemistry CAS names as altLabel: 1-Methyl-3-(difluoromethyl)-1<em>H</em>-pyrazole-4-carboxylic acid, 1-Methyl-3-(difluoromethyl)pyrazole-4-carboxylic acid, 1<em>H</em>-Pyrazole-4-carboxylic acid, 3-(difluoromethyl)-1-methyl-, 3-(Difluoromethyl)-1-methyl-7<em>H</em>-pyrazole-4-carboxylic acid, 3-Difluoromethyl-1-methyl-1<em>H</em>-pyrazol-4-carboxylic acid, 3-Difluoromethyl-1-methyl-1<em>H</em>-pyrazole-4-carboxylic acid, 3-Difluoromethyl-1-methylpyrazole-4-carboxylic acid; object_uuid=fo-e76296535832dda7 |
| 261,786 | consensus_match | cas_match_labels | — | {"176969-34-9":"exactMatch"} | group_key=3-(difluoromethyl)-1-methyl-1h-pyrazole-4-carboxylicacid||dimension=Environmental > media=Air > strata=Unknown; group_sources=['pubchem']; cas_sources={'176969-34-9': ['pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-e76296535832dda7: {'176969-34-9': 'exactMatch'} |
| 273,750 | opsin_iupac | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C6H6F2N2O2… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C6H6F2N2O2… | opsin_iupac: set authoritative IUPAC name, SMILES, InChI from '3-(difluoromethyl)-1-methyl-1h-pyrazole-4-carboxylic Acid' |
| 280,128 | rdkit_post_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C6H6F2N2O2… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C6H6F2N2O2… | rdkit_post_consensus from 'Cn1cc(C(=O)O)c(C(F)F)n1'; confirmed: smiles_string, inchi2d_string, inchi2d_key_string, molecular_formula, molecular_mass, monoisotopic_mass |
| 292,004 | dedupe_altlabels | altLabel | [{"@value":"1-Methyl-3-(difluoromethyl)-1<em>H</em>-pyrazole-4-carboxylic acid","@language":"en","source":{"prov:wasGen… | [{"@value":"1-Methyl-3-(difluoromethyl)-1H-pyrazole-4-carboxylic acid","@language":"en","source":{"prov:wasGeneratedBy"… | Deduplicated altLabel values and removed entries matching prefLabel |
| 340,150 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/73210f98-f5eb-… | associations resolved on the elementary layer |
| 388,025 | normalise_property_values | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C6H6F2N2O2… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C6H6F2N2O2… | typed the way the ontology types it |
| 394,610 | 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/20260820T1812399309960000/1146 | prefLabel | ef:agent/bootstrap_labels | ef:flow/73210f98-f5eb-4bf1-a86a-db94a396d6fd/v0 | ef:flow/73210f98-f5eb-4bf1-a86a-db94a396d6fd/v1 |
| ef:activity/change/20260820T1812399309960000/1147 | name | ef:agent/bootstrap_labels | ef:flow/73210f98-f5eb-4bf1-a86a-db94a396d6fd/v1 | ef:flow/73210f98-f5eb-4bf1-a86a-db94a396d6fd/v2 |
| ef:activity/change/20260820T1812399309960000/1148 | synonyms | ef:agent/bootstrap_labels | ef:flow/73210f98-f5eb-4bf1-a86a-db94a396d6fd/v2 | ef:flow/73210f98-f5eb-4bf1-a86a-db94a396d6fd/v3 |
| ef:activity/change/20260820T1812399309960000/118318 | context | ef:agent/default_context_mapping | ef:flow/73210f98-f5eb-4bf1-a86a-db94a396d6fd/v3 | ef:flow/73210f98-f5eb-4bf1-a86a-db94a396d6fd/v4 |
| ef:activity/change/20260820T1812399309960000/118319 | context_iri | ef:agent/default_context_mapping | ef:flow/73210f98-f5eb-4bf1-a86a-db94a396d6fd/v4 | ef:flow/73210f98-f5eb-4bf1-a86a-db94a396d6fd/v5 |
| ef:activity/change/20260820T1812399309960000/213717 | unit_iri | ef:agent/unit_normalization | ef:flow/73210f98-f5eb-4bf1-a86a-db94a396d6fd/v5 | ef:flow/73210f98-f5eb-4bf1-a86a-db94a396d6fd/v6 |
| ef:activity/change/20260820T1812399309960000/221356 | prefLabel | ef:agent/normalize_name_case | ef:flow/73210f98-f5eb-4bf1-a86a-db94a396d6fd/v6 | ef:flow/73210f98-f5eb-4bf1-a86a-db94a396d6fd/v7 |
| ef:activity/change/20260820T1812399309960000/228273 | properties | ef:agent/enrich_references | ef:flow/73210f98-f5eb-4bf1-a86a-db94a396d6fd/v7 | ef:flow/73210f98-f5eb-4bf1-a86a-db94a396d6fd/v8 |
| ef:activity/change/20260820T1812399309960000/228274 | skos_definition | ef:agent/enrich_references | ef:flow/73210f98-f5eb-4bf1-a86a-db94a396d6fd/v8 | ef:flow/73210f98-f5eb-4bf1-a86a-db94a396d6fd/v9 |
| ef:activity/change/20260820T1812399309960000/228275 | references | ef:agent/enrich_references | ef:flow/73210f98-f5eb-4bf1-a86a-db94a396d6fd/v9 | ef:flow/73210f98-f5eb-4bf1-a86a-db94a396d6fd/v10 |
| ef:activity/change/20260820T1812399309960000/248628 | properties | ef:agent/rdkit_pre_consensus | ef:flow/73210f98-f5eb-4bf1-a86a-db94a396d6fd/v10 | ef:flow/73210f98-f5eb-4bf1-a86a-db94a396d6fd/v11 |
| ef:activity/change/20260820T1812399309960000/261785 | altLabel | ef:agent/consensus_match | ef:flow/73210f98-f5eb-4bf1-a86a-db94a396d6fd/v11 | ef:flow/73210f98-f5eb-4bf1-a86a-db94a396d6fd/v12 |
| ef:activity/change/20260820T1812399309960000/261786 | cas_match_labels | ef:agent/consensus_match | ef:flow/73210f98-f5eb-4bf1-a86a-db94a396d6fd/v12 | ef:flow/73210f98-f5eb-4bf1-a86a-db94a396d6fd/v13 |
| ef:activity/change/20260820T1812399309960000/273750 | properties | ef:agent/opsin_iupac | ef:flow/73210f98-f5eb-4bf1-a86a-db94a396d6fd/v13 | ef:flow/73210f98-f5eb-4bf1-a86a-db94a396d6fd/v14 |
| ef:activity/change/20260820T1812399309960000/280128 | properties | ef:agent/rdkit_post_consensus | ef:flow/73210f98-f5eb-4bf1-a86a-db94a396d6fd/v14 | ef:flow/73210f98-f5eb-4bf1-a86a-db94a396d6fd/v15 |
| ef:activity/change/20260820T1812399309960000/292004 | altLabel | ef:agent/dedupe_altlabels | ef:flow/73210f98-f5eb-4bf1-a86a-db94a396d6fd/v15 | ef:flow/73210f98-f5eb-4bf1-a86a-db94a396d6fd/v16 |
| ef:activity/change/20260820T1812399309960000/340150 | concept_associations | ef:agent/carry_associations_onto_flows | ef:flow/73210f98-f5eb-4bf1-a86a-db94a396d6fd/v16 | ef:flow/73210f98-f5eb-4bf1-a86a-db94a396d6fd/v17 |
| ef:activity/change/20260820T1812399309960000/388025 | properties | ef:agent/normalise_property_values | ef:flow/73210f98-f5eb-4bf1-a86a-db94a396d6fd/v17 | ef:flow/73210f98-f5eb-4bf1-a86a-db94a396d6fd/v18 |
| ef:activity/change/20260820T1812399309960000/394610 | types | ef:agent/link_flows_to_their_substance | ef:flow/73210f98-f5eb-4bf1-a86a-db94a396d6fd/v18 | ef:flow/73210f98-f5eb-4bf1-a86a-db94a396d6fd/v19 |