1-chloro-4-isocyanato-2-(trifluoromethyl) Benzene
Everything that changed this flow. Back to the flow
4ddbcd97-7503-4a6c-885a-1d42049b8ef4
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=1-chloro-4-isocyanato-2-(trifluoromethyl)benzene||dimension=Environmental > media=Water > water_body=Ocean; group_sources=['pubchem']; cas_sources={'327-78-6': ['pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-c0848eda59efef07: {'327-78-6': '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 |
| 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 |
| name | 1 | bootstrap_labels | Purged legacy name field to enforce prefLabel usage |
| references | 1 | enrich_references | Added references with provenance; cas_numbers=['327-78-6']; matched_chebi_ids=[]; candidate_pubchem_cids=[2733265]; selected_pubchem_cids=[2733265]; 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 |
|---|---|---|---|---|---|
| 21,237 | bootstrap_labels | prefLabel | — | [{"@value":"1-chloro-4-isocyanato-2-(trifluoromethyl) benzene","@language":"en","source":{"prov:wasGeneratedBy":"bootst… | Bootstrapped prefLabel from legacy name field |
| 21,238 | bootstrap_labels | name | 1-chloro-4-isocyanato-2-(trifluoromethyl) benzene | — | Purged legacy name field to enforce prefLabel usage |
| 21,239 | bootstrap_labels | synonyms | ["organic","benzene,1-chloro-4-isocyanato-2-(trifluoromethyl)-"] | [] | Removed legacy synonyms field in favor of structured labels |
| 96,178 | default_context_mapping | context | — | {"dimension":"Environmental","media":"Water","water_body":"Unknown"} | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to water > Emissions to water, unspecified |
| 96,179 | default_context_mapping | context_iri | — | https://vocab.brightway.one/flow-contexts/envi-wate-unkn | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to water > Emissions to water, unspecified |
| 220,170 | unit_normalization | unit_iri | — | https://vocab.brightway.one/units/unit/KiloGM | Unit IRI set from normalization of 'kg' |
| 225,900 | normalize_name_case | prefLabel | [{"@value":"1-chloro-4-isocyanato-2-(trifluoromethyl) benzene","@language":"en","source":{"prov:wasGeneratedBy":"bootst… | [{"@value":"1-chloro-4-isocyanato-2-(trifluoromethyl) Benzene","@language":"en","source":{"prov:wasGeneratedBy":"bootst… | Title-cased words without internal capitals (preserved words with uppercase letters beyond the first character) |
| 246,656 | enrich_references | properties | {} | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C8H3ClF3NO… | Added ChEBI/PubChem properties (chebi_ids=0, pubchem_cids=1) |
| 246,657 | enrich_references | skos_definition | — | [] | Merged ChEBI/PubChem definitions into skos:definition |
| 246,658 | enrich_references | references | [] | [{"@id":"http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J2.820.989D","provenance":{"prov:wasGeneratedBy":"enrich_refer… | Added references with provenance; cas_numbers=['327-78-6']; matched_chebi_ids=[]; candidate_pubchem_cids=[2733265]; selected_pubchem_cids=[2733265]; 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 |
| 253,938 | rdkit_pre_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C8H3ClF3NO… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C8H3ClF3NO… | rdkit_pre_consensus from 'C1=CC(=C(C=C1N=C=O)C(F)(F)F)Cl'; added: molecular_mass, monoisotopic_mass |
| 259,088 | consensus_match | altLabel | [] | [{"@value":"1-Chloro-4-isocyanato-2-(trifluoromethyl)benzene","@language":"en","source":{"prov:wasGeneratedBy":"consens… | group_key=1-chloro-4-isocyanato-2-(trifluoromethyl)benzene||dimension=Environmental > media=Water > water_body=Ocean; cas=327-78-6; added Common Chemistry CAS names as altLabel: 1-Chloro-4-isocyanato-2-(trifluoromethyl)benzene, 3-Trifluoromethyl-4-chlorophenyl isocyanate, 4-Chloro-1-isocyanato-3-trifluoromethylbenzene, 4-Chloro-3-(trifluoromethyl)phenyl isocyanate, 4-Chloro-α,α,α-trifluoro-<em>m</em>-tolyl isocyanate, Benzene, 1-chloro-4-isocyanato-2-(trifluoromethyl)-, Isocyanic acid, 4-chloro-α,α,α-trifluoro-<em>m</em>-tolyl ester; object_uuid=fo-c0848eda59efef07 |
| 259,089 | consensus_match | cas_match_labels | — | {"327-78-6":"exactMatch"} | group_key=1-chloro-4-isocyanato-2-(trifluoromethyl)benzene||dimension=Environmental > media=Water > water_body=Ocean; group_sources=['pubchem']; cas_sources={'327-78-6': ['pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-c0848eda59efef07: {'327-78-6': 'exactMatch'} |
| 279,123 | opsin_iupac | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C8H3ClF3NO… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C8H3ClF3NO… | opsin_iupac: set authoritative IUPAC name, SMILES, InChI from '1-chloro-4-isocyanato-2-(trifluoromethyl) Benzene' |
| 285,976 | rdkit_post_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C8H3ClF3NO… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C8H3ClF3NO… | rdkit_post_consensus from 'O=C=Nc1ccc(Cl)c(C(F)(F)F)c1'; confirmed: smiles_string, inchi2d_string, inchi2d_key_string, molecular_formula, molecular_mass, monoisotopic_mass |
| 293,110 | dedupe_altlabels | altLabel | [{"@value":"1-Chloro-4-isocyanato-2-(trifluoromethyl)benzene","@language":"en","source":{"prov:wasGeneratedBy":"consens… | [{"@value":"1-Chloro-4-isocyanato-2-(trifluoromethyl)benzene","@language":"en","source":{"prov:wasGeneratedBy":"consens… | Deduplicated altLabel values and removed entries matching prefLabel |
| 329,080 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/4ddbcd97-7503-… | associations resolved on the elementary layer |
| 393,511 | normalise_property_values | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C8H3ClF3NO… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C8H3ClF3NO… | typed the way the ontology types it |
| 402,528 | 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/20260820T1812399309960000/21237 | prefLabel | ef:agent/bootstrap_labels | ef:flow/4ddbcd97-7503-4a6c-885a-1d42049b8ef4/v0 | ef:flow/4ddbcd97-7503-4a6c-885a-1d42049b8ef4/v1 |
| ef:activity/change/20260820T1812399309960000/21238 | name | ef:agent/bootstrap_labels | ef:flow/4ddbcd97-7503-4a6c-885a-1d42049b8ef4/v1 | ef:flow/4ddbcd97-7503-4a6c-885a-1d42049b8ef4/v2 |
| ef:activity/change/20260820T1812399309960000/21239 | synonyms | ef:agent/bootstrap_labels | ef:flow/4ddbcd97-7503-4a6c-885a-1d42049b8ef4/v2 | ef:flow/4ddbcd97-7503-4a6c-885a-1d42049b8ef4/v3 |
| ef:activity/change/20260820T1812399309960000/96178 | context | ef:agent/default_context_mapping | ef:flow/4ddbcd97-7503-4a6c-885a-1d42049b8ef4/v3 | ef:flow/4ddbcd97-7503-4a6c-885a-1d42049b8ef4/v4 |
| ef:activity/change/20260820T1812399309960000/96179 | context_iri | ef:agent/default_context_mapping | ef:flow/4ddbcd97-7503-4a6c-885a-1d42049b8ef4/v4 | ef:flow/4ddbcd97-7503-4a6c-885a-1d42049b8ef4/v5 |
| ef:activity/change/20260820T1812399309960000/220170 | unit_iri | ef:agent/unit_normalization | ef:flow/4ddbcd97-7503-4a6c-885a-1d42049b8ef4/v5 | ef:flow/4ddbcd97-7503-4a6c-885a-1d42049b8ef4/v6 |
| ef:activity/change/20260820T1812399309960000/225900 | prefLabel | ef:agent/normalize_name_case | ef:flow/4ddbcd97-7503-4a6c-885a-1d42049b8ef4/v6 | ef:flow/4ddbcd97-7503-4a6c-885a-1d42049b8ef4/v7 |
| ef:activity/change/20260820T1812399309960000/246656 | properties | ef:agent/enrich_references | ef:flow/4ddbcd97-7503-4a6c-885a-1d42049b8ef4/v7 | ef:flow/4ddbcd97-7503-4a6c-885a-1d42049b8ef4/v8 |
| ef:activity/change/20260820T1812399309960000/246657 | skos_definition | ef:agent/enrich_references | ef:flow/4ddbcd97-7503-4a6c-885a-1d42049b8ef4/v8 | ef:flow/4ddbcd97-7503-4a6c-885a-1d42049b8ef4/v9 |
| ef:activity/change/20260820T1812399309960000/246658 | references | ef:agent/enrich_references | ef:flow/4ddbcd97-7503-4a6c-885a-1d42049b8ef4/v9 | ef:flow/4ddbcd97-7503-4a6c-885a-1d42049b8ef4/v10 |
| ef:activity/change/20260820T1812399309960000/253938 | properties | ef:agent/rdkit_pre_consensus | ef:flow/4ddbcd97-7503-4a6c-885a-1d42049b8ef4/v10 | ef:flow/4ddbcd97-7503-4a6c-885a-1d42049b8ef4/v11 |
| ef:activity/change/20260820T1812399309960000/259088 | altLabel | ef:agent/consensus_match | ef:flow/4ddbcd97-7503-4a6c-885a-1d42049b8ef4/v11 | ef:flow/4ddbcd97-7503-4a6c-885a-1d42049b8ef4/v12 |
| ef:activity/change/20260820T1812399309960000/259089 | cas_match_labels | ef:agent/consensus_match | ef:flow/4ddbcd97-7503-4a6c-885a-1d42049b8ef4/v12 | ef:flow/4ddbcd97-7503-4a6c-885a-1d42049b8ef4/v13 |
| ef:activity/change/20260820T1812399309960000/279123 | properties | ef:agent/opsin_iupac | ef:flow/4ddbcd97-7503-4a6c-885a-1d42049b8ef4/v13 | ef:flow/4ddbcd97-7503-4a6c-885a-1d42049b8ef4/v14 |
| ef:activity/change/20260820T1812399309960000/285976 | properties | ef:agent/rdkit_post_consensus | ef:flow/4ddbcd97-7503-4a6c-885a-1d42049b8ef4/v14 | ef:flow/4ddbcd97-7503-4a6c-885a-1d42049b8ef4/v15 |
| ef:activity/change/20260820T1812399309960000/293110 | altLabel | ef:agent/dedupe_altlabels | ef:flow/4ddbcd97-7503-4a6c-885a-1d42049b8ef4/v15 | ef:flow/4ddbcd97-7503-4a6c-885a-1d42049b8ef4/v16 |
| ef:activity/change/20260820T1812399309960000/329080 | concept_associations | ef:agent/carry_associations_onto_flows | ef:flow/4ddbcd97-7503-4a6c-885a-1d42049b8ef4/v16 | ef:flow/4ddbcd97-7503-4a6c-885a-1d42049b8ef4/v17 |
| ef:activity/change/20260820T1812399309960000/393511 | properties | ef:agent/normalise_property_values | ef:flow/4ddbcd97-7503-4a6c-885a-1d42049b8ef4/v17 | ef:flow/4ddbcd97-7503-4a6c-885a-1d42049b8ef4/v18 |
| ef:activity/change/20260820T1812399309960000/402528 | types | ef:agent/link_flows_to_their_substance | ef:flow/4ddbcd97-7503-4a6c-885a-1d42049b8ef4/v18 | ef:flow/4ddbcd97-7503-4a6c-885a-1d42049b8ef4/v19 |