3-trifluoromethyl-4-nitrophenol
Everything that changed this flow. Back to the flow
fe0acd60-3ddc-11dd-a9fc-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 | 2 | consensus_match, strip_catalogue_altlabels | Removed 1 catalogue altLabel value(s): 'NSC 59758' (registry code) |
| cas_match_labels | 1 | consensus_match | group_key=3-trifluoromethyl-4-nitrophenol||dimension=Environmental > media=Air > indoor=Unknown; group_sources=['ec_inventory', 'pubchem']; cas_sources={'88-30-2': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-111233a53584e54e: {'88-30-2': '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 air > Emissions to urban air close to ground |
| context_iri | 1 | default_context_mapping | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to air > Emissions to urban air close to ground |
| 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=['88-30-2']; matched_chebi_ids=[]; candidate_pubchem_cids=[6931, 6921879]; selected_pubchem_cids=[6931]; 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
18| # | Step | Field | From | To | Why |
|---|---|---|---|---|---|
| 25,442 | bootstrap_labels | prefLabel | — | [{"@value":"3-trifluoromethyl-4-nitrophenol","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:… | Bootstrapped prefLabel from legacy name field |
| 25,443 | bootstrap_labels | name | 3-trifluoromethyl-4-nitrophenol | — | Purged legacy name field to enforce prefLabel usage |
| 25,535 | bootstrap_labels | synonyms | [".alpha.,.alpha.,.alpha.-Trifluoro-4-nitro-m-cresol","2-nitro-5-hydroxy(trifluoromethyl)benzene","3-(Trifluoromethyl)-… | [] | Removed legacy synonyms field in favor of structured labels |
| 208,228 | default_context_mapping | context | — | {"dimension":"Environmental","media":"Air","strata":"Ground level","population_density":"Urban (>1000 people/square mil… | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to air > Emissions to urban air close to ground |
| 208,229 | default_context_mapping | context_iri | — | https://vocab.brightway.one/flow-contexts/envi-air-grle-ur10pesq | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to air > Emissions to urban air close to ground |
| 221,002 | unit_normalization | unit_iri | — | https://vocab.brightway.one/units/unit/KiloGM | Unit IRI set from normalization of 'kg' |
| 248,211 | enrich_references | properties | {} | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C7H4F3NO3"… | Added ChEBI/PubChem properties (chebi_ids=0, pubchem_cids=1) |
| 248,212 | enrich_references | skos_definition | — | [] | Merged ChEBI/PubChem definitions into skos:definition |
| 248,213 | enrich_references | references | [] | [{"@id":"http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J4.292G","provenance":{"prov:wasGeneratedBy":"enrich_reference… | Added references with provenance; cas_numbers=['88-30-2']; matched_chebi_ids=[]; candidate_pubchem_cids=[6931, 6921879]; selected_pubchem_cids=[6931]; 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 |
| 254,359 | rdkit_pre_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C7H4F3NO3"… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C7H4F3NO3"… | rdkit_pre_consensus from 'C1=CC(=C(C=C1O)C(F)(F)F)[N+](=O)[O-]'; added: molecular_mass, monoisotopic_mass |
| 262,227 | consensus_match | altLabel | [] | [{"@value":"1-Nitro-4-hydroxy-2-(trifluoromethyl)benzene","@language":"en","source":{"prov:wasGeneratedBy":"consensus_m… | group_key=3-trifluoromethyl-4-nitrophenol||dimension=Environmental > media=Air > indoor=Unknown; cas=88-30-2; added Common Chemistry CAS names as altLabel: 1-Nitro-4-hydroxy-2-(trifluoromethyl)benzene, 3-(Trifluoromethyl)-4-nitrophenol, 4-Nitro-3-(trifluoromethyl)phenol, 5-Hydroxy-2-nitrobenzotrifluoride, <em>m</em>-Cresol, α,α,α-trifluoro-4-nitro-, Lamprecid, NSC 59758, Phenol, 4-nitro-3-(trifluoromethyl)-, α,α,α-Trifluoro-4-nitro-<em>m</em>-cresol; object_uuid=fo-111233a53584e54e |
| 262,228 | consensus_match | cas_match_labels | — | {"88-30-2":"exactMatch"} | group_key=3-trifluoromethyl-4-nitrophenol||dimension=Environmental > media=Air > indoor=Unknown; group_sources=['ec_inventory', 'pubchem']; cas_sources={'88-30-2': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-111233a53584e54e: {'88-30-2': 'exactMatch'} |
| 279,719 | opsin_iupac | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C7H4F3NO3"… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C7H4F3NO3"… | opsin_iupac: set authoritative IUPAC name, SMILES, InChI from '3-trifluoromethyl-4-nitrophenol' |
| 286,613 | rdkit_post_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C7H4F3NO3"… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C7H4F3NO3"… | rdkit_post_consensus from 'O=[N+]([O-])c1ccc(O)cc1C(F)(F)F'; confirmed: smiles_string, inchi2d_string, inchi2d_key_string, molecular_formula, molecular_mass, monoisotopic_mass |
| 291,836 | strip_catalogue_altlabels | altLabel | [{"@value":"1-Nitro-4-hydroxy-2-(trifluoromethyl)benzene","@language":"en","source":{"prov:wasGeneratedBy":"consensus_m… | [{"@value":"1-Nitro-4-hydroxy-2-(trifluoromethyl)benzene","@language":"en","source":{"prov:wasGeneratedBy":"consensus_m… | Removed 1 catalogue altLabel value(s): 'NSC 59758' (registry code) |
| 385,153 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/fe0acd60-3ddc-… | associations resolved on the elementary layer |
| 394,126 | normalise_property_values | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C7H4F3NO3"… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C7H4F3NO3"… | typed the way the ontology types it |
| 403,639 | link_flows_to_their_substance | types | — | ["https://w3id.org/chemrof/NeutralMolecule"] | the substance's answer, copied onto its flow |
PROV-O trail
18 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/20260821T1554374006150000/25442 | prefLabel | ef:agent/bootstrap_labels | ef:flow/fe0acd60-3ddc-11dd-a9fc-0050c2490048/v0 | ef:flow/fe0acd60-3ddc-11dd-a9fc-0050c2490048/v1 |
| ef:activity/change/20260821T1554374006150000/25443 | name | ef:agent/bootstrap_labels | ef:flow/fe0acd60-3ddc-11dd-a9fc-0050c2490048/v1 | ef:flow/fe0acd60-3ddc-11dd-a9fc-0050c2490048/v2 |
| ef:activity/change/20260821T1554374006150000/25535 | synonyms | ef:agent/bootstrap_labels | ef:flow/fe0acd60-3ddc-11dd-a9fc-0050c2490048/v2 | ef:flow/fe0acd60-3ddc-11dd-a9fc-0050c2490048/v3 |
| ef:activity/change/20260821T1554374006150000/208228 | context | ef:agent/default_context_mapping | ef:flow/fe0acd60-3ddc-11dd-a9fc-0050c2490048/v3 | ef:flow/fe0acd60-3ddc-11dd-a9fc-0050c2490048/v4 |
| ef:activity/change/20260821T1554374006150000/208229 | context_iri | ef:agent/default_context_mapping | ef:flow/fe0acd60-3ddc-11dd-a9fc-0050c2490048/v4 | ef:flow/fe0acd60-3ddc-11dd-a9fc-0050c2490048/v5 |
| ef:activity/change/20260821T1554374006150000/221002 | unit_iri | ef:agent/unit_normalization | ef:flow/fe0acd60-3ddc-11dd-a9fc-0050c2490048/v5 | ef:flow/fe0acd60-3ddc-11dd-a9fc-0050c2490048/v6 |
| ef:activity/change/20260821T1554374006150000/248211 | properties | ef:agent/enrich_references | ef:flow/fe0acd60-3ddc-11dd-a9fc-0050c2490048/v6 | ef:flow/fe0acd60-3ddc-11dd-a9fc-0050c2490048/v7 |
| ef:activity/change/20260821T1554374006150000/248212 | skos_definition | ef:agent/enrich_references | ef:flow/fe0acd60-3ddc-11dd-a9fc-0050c2490048/v7 | ef:flow/fe0acd60-3ddc-11dd-a9fc-0050c2490048/v8 |
| ef:activity/change/20260821T1554374006150000/248213 | references | ef:agent/enrich_references | ef:flow/fe0acd60-3ddc-11dd-a9fc-0050c2490048/v8 | ef:flow/fe0acd60-3ddc-11dd-a9fc-0050c2490048/v9 |
| ef:activity/change/20260821T1554374006150000/254359 | properties | ef:agent/rdkit_pre_consensus | ef:flow/fe0acd60-3ddc-11dd-a9fc-0050c2490048/v9 | ef:flow/fe0acd60-3ddc-11dd-a9fc-0050c2490048/v10 |
| ef:activity/change/20260821T1554374006150000/262227 | altLabel | ef:agent/consensus_match | ef:flow/fe0acd60-3ddc-11dd-a9fc-0050c2490048/v10 | ef:flow/fe0acd60-3ddc-11dd-a9fc-0050c2490048/v11 |
| ef:activity/change/20260821T1554374006150000/262228 | cas_match_labels | ef:agent/consensus_match | ef:flow/fe0acd60-3ddc-11dd-a9fc-0050c2490048/v11 | ef:flow/fe0acd60-3ddc-11dd-a9fc-0050c2490048/v12 |
| ef:activity/change/20260821T1554374006150000/279719 | properties | ef:agent/opsin_iupac | ef:flow/fe0acd60-3ddc-11dd-a9fc-0050c2490048/v12 | ef:flow/fe0acd60-3ddc-11dd-a9fc-0050c2490048/v13 |
| ef:activity/change/20260821T1554374006150000/286613 | properties | ef:agent/rdkit_post_consensus | ef:flow/fe0acd60-3ddc-11dd-a9fc-0050c2490048/v13 | ef:flow/fe0acd60-3ddc-11dd-a9fc-0050c2490048/v14 |
| ef:activity/change/20260821T1554374006150000/291836 | altLabel | ef:agent/strip_catalogue_altlabels | ef:flow/fe0acd60-3ddc-11dd-a9fc-0050c2490048/v14 | ef:flow/fe0acd60-3ddc-11dd-a9fc-0050c2490048/v15 |
| ef:activity/change/20260821T1554374006150000/385153 | concept_associations | ef:agent/carry_associations_onto_flows | ef:flow/fe0acd60-3ddc-11dd-a9fc-0050c2490048/v15 | ef:flow/fe0acd60-3ddc-11dd-a9fc-0050c2490048/v16 |
| ef:activity/change/20260821T1554374006150000/394126 | properties | ef:agent/normalise_property_values | ef:flow/fe0acd60-3ddc-11dd-a9fc-0050c2490048/v16 | ef:flow/fe0acd60-3ddc-11dd-a9fc-0050c2490048/v17 |
| ef:activity/change/20260821T1554374006150000/403639 | types | ef:agent/link_flows_to_their_substance | ef:flow/fe0acd60-3ddc-11dd-a9fc-0050c2490048/v17 | ef:flow/fe0acd60-3ddc-11dd-a9fc-0050c2490048/v18 |