4-chloro-1-nitro-2-(trifluoromethyl)benzene
Everything that changed this flow. Back to the flow
adc67700-ed16-40fd-908e-31add05acead
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=4-chloro-1-nitro-2-(trifluoromethyl)benzene||dimension=Environmental > media=Air > strata=Unknown; cas=118-83-2; added Common Chemistry CAS names as altLabel: 2-Nitro-5-chlorobenzotrifluoride, 4-Chloro-2-(trifluoromethyl)nitrobenzene, 4-Nitro-3-trifluoromethyl-1-chlorobenzene, 5-Chloro-2-nitro(trifluoromethyl)benzene, 5-Chloro-2-nitro-1-(trifluoromethyl)benzene, 5-Chloro-2-nitrobenzotrifluoride, 5-Chloro-α,α,α-trifluoro-2-nitrotoluene, Benzene, 4-chloro-1-nitro-2-(trifluoromethyl)-, Toluene, 5-chloro-α,α,α-trifluoro-2-nitro-; object_uuid=fo-9e1e9c6769dbfa3a |
| cas_match_labels | 1 | consensus_match | group_key=4-chloro-1-nitro-2-(trifluoromethyl)benzene||dimension=Environmental > media=Air > strata=Unknown; group_sources=['ec_inventory', 'pubchem']; cas_sources={'118-83-2': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-9e1e9c6769dbfa3a: {'118-83-2': '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 non-urban air or from high stacks |
| context_iri | 1 | default_context_mapping | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to air > Emissions to non-urban air or from high stacks |
| 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=['118-83-2']; matched_chebi_ids=[]; candidate_pubchem_cids=[67052, 77134456]; selected_pubchem_cids=[67052]; 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 |
|---|---|---|---|---|---|
| 12,466 | bootstrap_labels | prefLabel | — | [{"@value":"4-chloro-1-nitro-2-(trifluoromethyl)benzene","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_la… | Bootstrapped prefLabel from legacy name field |
| 12,467 | bootstrap_labels | name | 4-chloro-1-nitro-2-(trifluoromethyl)benzene | — | Purged legacy name field to enforce prefLabel usage |
| 12,468 | bootstrap_labels | synonyms | ["organic","5-chloro-î±,î±,î±-trifluoro-2-nitrotoluene","5-chlor-2-nitrobenzotrifluorid","nitro-vd"] | [] | Removed legacy synonyms field in favor of structured labels |
| 153,230 | default_context_mapping | context | — | {"dimension":"Environmental","media":"Air","strata":"Medium stack, <150 meters","population_density":"Rural (<1000 peop… | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to air > Emissions to non-urban air or from high stacks |
| 153,231 | default_context_mapping | context_iri | — | https://vocab.brightway.one/flow-contexts/envi-air-mest15me-ru10pesq | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to air > Emissions to non-urban air or from high stacks |
| 217,464 | unit_normalization | unit_iri | — | https://vocab.brightway.one/units/unit/KiloGM | Unit IRI set from normalization of 'kg' |
| 239,022 | enrich_references | properties | {} | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C7H3ClF3NO… | Added ChEBI/PubChem properties (chebi_ids=0, pubchem_cids=1) |
| 239,023 | enrich_references | skos_definition | — | [] | Merged ChEBI/PubChem definitions into skos:definition |
| 239,024 | enrich_references | references | [] | [{"@id":"http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J141.352J","provenance":{"prov:wasGeneratedBy":"enrich_referen… | Added references with provenance; cas_numbers=['118-83-2']; matched_chebi_ids=[]; candidate_pubchem_cids=[67052, 77134456]; selected_pubchem_cids=[67052]; 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 |
| 251,720 | rdkit_pre_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C7H3ClF3NO… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C7H3ClF3NO… | rdkit_pre_consensus from 'C1=CC(=C(C=C1Cl)C(F)(F)F)[N+](=O)[O-]'; added: molecular_mass, monoisotopic_mass |
| 262,618 | consensus_match | altLabel | [] | [{"@value":"2-Nitro-5-chlorobenzotrifluoride","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:… | group_key=4-chloro-1-nitro-2-(trifluoromethyl)benzene||dimension=Environmental > media=Air > strata=Unknown; cas=118-83-2; added Common Chemistry CAS names as altLabel: 2-Nitro-5-chlorobenzotrifluoride, 4-Chloro-2-(trifluoromethyl)nitrobenzene, 4-Nitro-3-trifluoromethyl-1-chlorobenzene, 5-Chloro-2-nitro(trifluoromethyl)benzene, 5-Chloro-2-nitro-1-(trifluoromethyl)benzene, 5-Chloro-2-nitrobenzotrifluoride, 5-Chloro-α,α,α-trifluoro-2-nitrotoluene, Benzene, 4-chloro-1-nitro-2-(trifluoromethyl)-, Toluene, 5-chloro-α,α,α-trifluoro-2-nitro-; object_uuid=fo-9e1e9c6769dbfa3a |
| 262,619 | consensus_match | cas_match_labels | — | {"118-83-2":"exactMatch"} | group_key=4-chloro-1-nitro-2-(trifluoromethyl)benzene||dimension=Environmental > media=Air > strata=Unknown; group_sources=['ec_inventory', 'pubchem']; cas_sources={'118-83-2': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-9e1e9c6769dbfa3a: {'118-83-2': 'exactMatch'} |
| 276,907 | opsin_iupac | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C7H3ClF3NO… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C7H3ClF3NO… | opsin_iupac: set authoritative IUPAC name, SMILES, InChI from '4-chloro-1-nitro-2-(trifluoromethyl)benzene' |
| 283,554 | rdkit_post_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C7H3ClF3NO… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C7H3ClF3NO… | rdkit_post_consensus from 'O=[N+]([O-])c1ccc(Cl)cc1C(F)(F)F'; confirmed: smiles_string, inchi2d_string, inchi2d_key_string, molecular_formula, molecular_mass, monoisotopic_mass |
| 357,638 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/adc67700-ed16-… | associations resolved on the elementary layer |
| 391,264 | normalise_property_values | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C7H3ClF3NO… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C7H3ClF3NO… | typed the way the ontology types it |
| 399,221 | 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/20260821T1554374006150000/12466 | prefLabel | ef:agent/bootstrap_labels | ef:flow/adc67700-ed16-40fd-908e-31add05acead/v0 | ef:flow/adc67700-ed16-40fd-908e-31add05acead/v1 |
| ef:activity/change/20260821T1554374006150000/12467 | name | ef:agent/bootstrap_labels | ef:flow/adc67700-ed16-40fd-908e-31add05acead/v1 | ef:flow/adc67700-ed16-40fd-908e-31add05acead/v2 |
| ef:activity/change/20260821T1554374006150000/12468 | synonyms | ef:agent/bootstrap_labels | ef:flow/adc67700-ed16-40fd-908e-31add05acead/v2 | ef:flow/adc67700-ed16-40fd-908e-31add05acead/v3 |
| ef:activity/change/20260821T1554374006150000/153230 | context | ef:agent/default_context_mapping | ef:flow/adc67700-ed16-40fd-908e-31add05acead/v3 | ef:flow/adc67700-ed16-40fd-908e-31add05acead/v4 |
| ef:activity/change/20260821T1554374006150000/153231 | context_iri | ef:agent/default_context_mapping | ef:flow/adc67700-ed16-40fd-908e-31add05acead/v4 | ef:flow/adc67700-ed16-40fd-908e-31add05acead/v5 |
| ef:activity/change/20260821T1554374006150000/217464 | unit_iri | ef:agent/unit_normalization | ef:flow/adc67700-ed16-40fd-908e-31add05acead/v5 | ef:flow/adc67700-ed16-40fd-908e-31add05acead/v6 |
| ef:activity/change/20260821T1554374006150000/239022 | properties | ef:agent/enrich_references | ef:flow/adc67700-ed16-40fd-908e-31add05acead/v6 | ef:flow/adc67700-ed16-40fd-908e-31add05acead/v7 |
| ef:activity/change/20260821T1554374006150000/239023 | skos_definition | ef:agent/enrich_references | ef:flow/adc67700-ed16-40fd-908e-31add05acead/v7 | ef:flow/adc67700-ed16-40fd-908e-31add05acead/v8 |
| ef:activity/change/20260821T1554374006150000/239024 | references | ef:agent/enrich_references | ef:flow/adc67700-ed16-40fd-908e-31add05acead/v8 | ef:flow/adc67700-ed16-40fd-908e-31add05acead/v9 |
| ef:activity/change/20260821T1554374006150000/251720 | properties | ef:agent/rdkit_pre_consensus | ef:flow/adc67700-ed16-40fd-908e-31add05acead/v9 | ef:flow/adc67700-ed16-40fd-908e-31add05acead/v10 |
| ef:activity/change/20260821T1554374006150000/262618 | altLabel | ef:agent/consensus_match | ef:flow/adc67700-ed16-40fd-908e-31add05acead/v10 | ef:flow/adc67700-ed16-40fd-908e-31add05acead/v11 |
| ef:activity/change/20260821T1554374006150000/262619 | cas_match_labels | ef:agent/consensus_match | ef:flow/adc67700-ed16-40fd-908e-31add05acead/v11 | ef:flow/adc67700-ed16-40fd-908e-31add05acead/v12 |
| ef:activity/change/20260821T1554374006150000/276907 | properties | ef:agent/opsin_iupac | ef:flow/adc67700-ed16-40fd-908e-31add05acead/v12 | ef:flow/adc67700-ed16-40fd-908e-31add05acead/v13 |
| ef:activity/change/20260821T1554374006150000/283554 | properties | ef:agent/rdkit_post_consensus | ef:flow/adc67700-ed16-40fd-908e-31add05acead/v13 | ef:flow/adc67700-ed16-40fd-908e-31add05acead/v14 |
| ef:activity/change/20260821T1554374006150000/357638 | concept_associations | ef:agent/carry_associations_onto_flows | ef:flow/adc67700-ed16-40fd-908e-31add05acead/v14 | ef:flow/adc67700-ed16-40fd-908e-31add05acead/v15 |
| ef:activity/change/20260821T1554374006150000/391264 | properties | ef:agent/normalise_property_values | ef:flow/adc67700-ed16-40fd-908e-31add05acead/v15 | ef:flow/adc67700-ed16-40fd-908e-31add05acead/v16 |
| ef:activity/change/20260821T1554374006150000/399221 | types | ef:agent/link_flows_to_their_substance | ef:flow/adc67700-ed16-40fd-908e-31add05acead/v16 | ef:flow/adc67700-ed16-40fd-908e-31add05acead/v17 |