1-chloro-4-(trifluoromethyl)benzene
Everything that changed this flow. Back to the flow
560fd19f-f8ca-4fb1-9954-efbff14ef650
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 4 catalogue altLabel value(s): 'NSC 10309' (registry code), 'Oxol 100' (grade code), 'Oxsol 100' (trade name), 'Oxsul 100' (trade name) |
| cas_match_labels | 1 | consensus_match | group_key=1-chloro-4-(trifluoromethyl)benzene||dimension=Environmental > media=Air > strata=Medium stack, <150 meters > population_density=Rural (<1000 people/square mile); group_sources=['ec_inventory', 'pubchem']; cas_sources={'98-56-6': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-53259a7aa1528d51: {'98-56-6': '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 water, unspecified (long-term) |
| context_iri | 1 | default_context_mapping | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to water > Emissions to water, unspecified (long-term) |
| 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=['98-56-6']; matched_chebi_ids=[]; candidate_pubchem_cids=[7394, 66717, 522689, 56632242]; selected_pubchem_cids=[7394]; 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 |
|---|---|---|---|---|---|
| 19,929 | bootstrap_labels | prefLabel | — | [{"@value":"1-chloro-4-(trifluoromethyl)benzene","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","p… | Bootstrapped prefLabel from legacy name field |
| 19,930 | bootstrap_labels | name | 1-chloro-4-(trifluoromethyl)benzene | — | Purged legacy name field to enforce prefLabel usage |
| 19,931 | bootstrap_labels | synonyms | ["organic","4-chloro-î±,î±,î±-trifluorotoluene","4-chlorobenzotrifluoride","p-chlorobenzotrifluoride","parachlorbenzotr… | [] | Removed legacy synonyms field in favor of structured labels |
| 100,974 | default_context_mapping | context | — | {"dimension":"Environmental","media":"Water","water_body":"Long-term"} | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to water > Emissions to water, unspecified (long-term) |
| 100,975 | default_context_mapping | context_iri | — | https://vocab.brightway.one/flow-contexts/envi-wate-lote | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to water > Emissions to water, unspecified (long-term) |
| 219,813 | unit_normalization | unit_iri | — | https://vocab.brightway.one/units/unit/KiloGM | Unit IRI set from normalization of 'kg' |
| 245,660 | enrich_references | properties | {} | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C7H4ClF3"]… | Added ChEBI/PubChem properties (chebi_ids=0, pubchem_cids=1) |
| 245,661 | enrich_references | skos_definition | — | [] | Merged ChEBI/PubChem definitions into skos:definition |
| 245,662 | enrich_references | references | [] | [{"@id":"http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J31.775F","provenance":{"prov:wasGeneratedBy":"enrich_referenc… | Added references with provenance; cas_numbers=['98-56-6']; matched_chebi_ids=[]; candidate_pubchem_cids=[7394, 66717, 522689, 56632242]; selected_pubchem_cids=[7394]; 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 |
| 253,643 | rdkit_pre_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C7H4ClF3"]… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C7H4ClF3"]… | rdkit_pre_consensus from 'C1=CC(=CC=C1C(F)(F)F)Cl'; added: molecular_mass, monoisotopic_mass |
| 259,086 | consensus_match | altLabel | [] | [{"@value":"(<em>p</em>-Chlorophenyl)trifluoromethane","@language":"en","source":{"prov:wasGeneratedBy":"consensus_matc… | group_key=1-chloro-4-(trifluoromethyl)benzene||dimension=Environmental > media=Air > strata=Medium stack, <150 meters > population_density=Rural (<1000 people/square mile); cas=98-56-6; added Common Chemistry CAS names as altLabel: (<em>p</em>-Chlorophenyl)trifluoromethane, 4-(Trifluoromethyl)chlorobenzene, 4-(Trifluoromethyl)phenyl chloride, 4-Chloro(trifluoromethyl)benzene, 4-Chloro-1-trifluoromethylbenzene, 4-Chloro-α,α,α-benzotrifluoride, 4-Chloro-α,α,α-trifluorotoluene, 4-Chlorobenzotrifluoride, 4-Chlorobenzyltrifluoride, 4-Trifluoromethyl-1-chlorobenzene, <em>p</em>-(Trifluoromethyl)chlorobenzene, <em>p</em>-Chloro(trifluoromethyl)benzene, <em>p</em>-Chloro-α,α,α-trifluorotoluene, <em>p</em>-Chlorobenzotrifluoride, <em>p</em>-Trifluoromethylphenyl chloride, Benzene, 1-chloro-4-(trifluoromethyl)-, NSC 10309, Oxol 100, Oxsol 100, Oxsul 100, Toluene, <em>p</em>-chloro-α,α,α-trifluoro-; object_uuid=fo-53259a7aa1528d51 |
| 259,087 | consensus_match | cas_match_labels | — | {"98-56-6":"exactMatch"} | group_key=1-chloro-4-(trifluoromethyl)benzene||dimension=Environmental > media=Air > strata=Medium stack, <150 meters > population_density=Rural (<1000 people/square mile); group_sources=['ec_inventory', 'pubchem']; cas_sources={'98-56-6': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-53259a7aa1528d51: {'98-56-6': 'exactMatch'} |
| 278,854 | opsin_iupac | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C7H4ClF3"]… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C7H4ClF3"]… | opsin_iupac: set authoritative IUPAC name, SMILES, InChI from '1-chloro-4-(trifluoromethyl)benzene' |
| 285,654 | rdkit_post_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C7H4ClF3"]… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C7H4ClF3"]… | rdkit_post_consensus from 'FC(F)(F)c1ccc(Cl)cc1'; confirmed: smiles_string, inchi2d_string, inchi2d_key_string, molecular_formula, molecular_mass, monoisotopic_mass |
| 291,231 | strip_catalogue_altlabels | altLabel | [{"@value":"(<em>p</em>-Chlorophenyl)trifluoromethane","@language":"en","source":{"prov:wasGeneratedBy":"consensus_matc… | [{"@value":"(p-Chlorophenyl)trifluoromethane","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:… | Removed 4 catalogue altLabel value(s): 'NSC 10309' (registry code), 'Oxol 100' (grade code), 'Oxsol 100' (trade name), 'Oxsul 100' (trade name) |
| 331,477 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/560fd19f-f8ca-… | associations resolved on the elementary layer |
| 393,223 | normalise_property_values | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C7H4ClF3"]… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C7H4ClF3"]… | typed the way the ontology types it |
| 402,085 | 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/20260820T1812399309960000/19929 | prefLabel | ef:agent/bootstrap_labels | ef:flow/560fd19f-f8ca-4fb1-9954-efbff14ef650/v0 | ef:flow/560fd19f-f8ca-4fb1-9954-efbff14ef650/v1 |
| ef:activity/change/20260820T1812399309960000/19930 | name | ef:agent/bootstrap_labels | ef:flow/560fd19f-f8ca-4fb1-9954-efbff14ef650/v1 | ef:flow/560fd19f-f8ca-4fb1-9954-efbff14ef650/v2 |
| ef:activity/change/20260820T1812399309960000/19931 | synonyms | ef:agent/bootstrap_labels | ef:flow/560fd19f-f8ca-4fb1-9954-efbff14ef650/v2 | ef:flow/560fd19f-f8ca-4fb1-9954-efbff14ef650/v3 |
| ef:activity/change/20260820T1812399309960000/100974 | context | ef:agent/default_context_mapping | ef:flow/560fd19f-f8ca-4fb1-9954-efbff14ef650/v3 | ef:flow/560fd19f-f8ca-4fb1-9954-efbff14ef650/v4 |
| ef:activity/change/20260820T1812399309960000/100975 | context_iri | ef:agent/default_context_mapping | ef:flow/560fd19f-f8ca-4fb1-9954-efbff14ef650/v4 | ef:flow/560fd19f-f8ca-4fb1-9954-efbff14ef650/v5 |
| ef:activity/change/20260820T1812399309960000/219813 | unit_iri | ef:agent/unit_normalization | ef:flow/560fd19f-f8ca-4fb1-9954-efbff14ef650/v5 | ef:flow/560fd19f-f8ca-4fb1-9954-efbff14ef650/v6 |
| ef:activity/change/20260820T1812399309960000/245660 | properties | ef:agent/enrich_references | ef:flow/560fd19f-f8ca-4fb1-9954-efbff14ef650/v6 | ef:flow/560fd19f-f8ca-4fb1-9954-efbff14ef650/v7 |
| ef:activity/change/20260820T1812399309960000/245661 | skos_definition | ef:agent/enrich_references | ef:flow/560fd19f-f8ca-4fb1-9954-efbff14ef650/v7 | ef:flow/560fd19f-f8ca-4fb1-9954-efbff14ef650/v8 |
| ef:activity/change/20260820T1812399309960000/245662 | references | ef:agent/enrich_references | ef:flow/560fd19f-f8ca-4fb1-9954-efbff14ef650/v8 | ef:flow/560fd19f-f8ca-4fb1-9954-efbff14ef650/v9 |
| ef:activity/change/20260820T1812399309960000/253643 | properties | ef:agent/rdkit_pre_consensus | ef:flow/560fd19f-f8ca-4fb1-9954-efbff14ef650/v9 | ef:flow/560fd19f-f8ca-4fb1-9954-efbff14ef650/v10 |
| ef:activity/change/20260820T1812399309960000/259086 | altLabel | ef:agent/consensus_match | ef:flow/560fd19f-f8ca-4fb1-9954-efbff14ef650/v10 | ef:flow/560fd19f-f8ca-4fb1-9954-efbff14ef650/v11 |
| ef:activity/change/20260820T1812399309960000/259087 | cas_match_labels | ef:agent/consensus_match | ef:flow/560fd19f-f8ca-4fb1-9954-efbff14ef650/v11 | ef:flow/560fd19f-f8ca-4fb1-9954-efbff14ef650/v12 |
| ef:activity/change/20260820T1812399309960000/278854 | properties | ef:agent/opsin_iupac | ef:flow/560fd19f-f8ca-4fb1-9954-efbff14ef650/v12 | ef:flow/560fd19f-f8ca-4fb1-9954-efbff14ef650/v13 |
| ef:activity/change/20260820T1812399309960000/285654 | properties | ef:agent/rdkit_post_consensus | ef:flow/560fd19f-f8ca-4fb1-9954-efbff14ef650/v13 | ef:flow/560fd19f-f8ca-4fb1-9954-efbff14ef650/v14 |
| ef:activity/change/20260820T1812399309960000/291231 | altLabel | ef:agent/strip_catalogue_altlabels | ef:flow/560fd19f-f8ca-4fb1-9954-efbff14ef650/v14 | ef:flow/560fd19f-f8ca-4fb1-9954-efbff14ef650/v15 |
| ef:activity/change/20260820T1812399309960000/331477 | concept_associations | ef:agent/carry_associations_onto_flows | ef:flow/560fd19f-f8ca-4fb1-9954-efbff14ef650/v15 | ef:flow/560fd19f-f8ca-4fb1-9954-efbff14ef650/v16 |
| ef:activity/change/20260820T1812399309960000/393223 | properties | ef:agent/normalise_property_values | ef:flow/560fd19f-f8ca-4fb1-9954-efbff14ef650/v16 | ef:flow/560fd19f-f8ca-4fb1-9954-efbff14ef650/v17 |
| ef:activity/change/20260820T1812399309960000/402085 | types | ef:agent/link_flows_to_their_substance | ef:flow/560fd19f-f8ca-4fb1-9954-efbff14ef650/v17 | ef:flow/560fd19f-f8ca-4fb1-9954-efbff14ef650/v18 |