2-chloro-1,3-dinitro-5-(trifluoromethyl)benzene
Everything that changed this substance, across every flow that resolves to it. Back to the substance
fo-cab8945cc1ecde98
Changes
54| # | Step | Field | From | To | Why |
|---|---|---|---|---|---|
| 2,064 | bootstrap_labels | prefLabel | — | [{"@value":"2-chloro-1,3-dinitro-5-(trifluoromethyl)benzene","@language":"en","source":{"prov:wasGeneratedBy":"bootstra… | Bootstrapped prefLabel from legacy name field |
| 2,065 | bootstrap_labels | name | 2-chloro-1,3-dinitro-5-(trifluoromethyl)benzene | — | Purged legacy name field to enforce prefLabel usage |
| 2,066 | bootstrap_labels | synonyms | ["organic","4-chloro-3,5-dinitro-î±,î±,î±-trifluorotoluene"] | [] | Removed legacy synonyms field in favor of structured labels |
| 27,354 | default_context_mapping | context | — | {"dimension":"Environmental","media":"Air","indoor":"Unknown"} | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to air > Emissions to air, indoor |
| 27,355 | default_context_mapping | context_iri | — | https://vocab.brightway.one/flow-contexts/envi-air-indr-unkn | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to air > Emissions to air, indoor |
| 45,766 | 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 |
| 45,767 | 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 |
| 60,306 | default_context_mapping | context | — | {"dimension":"Environmental","media":"Air","strata":"Long-term"} | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to air > Emissions to air, unspecified (long-term) |
| 60,307 | default_context_mapping | context_iri | — | https://vocab.brightway.one/flow-contexts/envi-air-lote | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to air > Emissions to air, unspecified (long-term) |
| 60,452 | 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 |
| 60,453 | 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 |
| 71,526 | default_context_mapping | context | — | {"dimension":"Environmental","media":"Ground","geography":"Unknown"} | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to soil > Emissions to soil, unspecified |
| 71,527 | default_context_mapping | context_iri | — | https://vocab.brightway.one/flow-contexts/envi-grou-unkn | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to soil > Emissions to soil, unspecified |
| 83,484 | default_context_mapping | context | — | {"dimension":"Environmental","media":"Ground","geography":"Agricultural"} | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to soil > Emissions to agricultural soil |
| 83,485 | default_context_mapping | context_iri | — | https://vocab.brightway.one/flow-contexts/envi-grou-agri | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to soil > Emissions to agricultural soil |
| 84,324 | 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 |
| 84,325 | 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 |
| 125,216 | default_context_mapping | context | — | {"dimension":"Environmental","media":"Ground","geography":"Non-agricultural"} | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to soil > Emissions to non-agricultural soil |
| 125,217 | default_context_mapping | context_iri | — | https://vocab.brightway.one/flow-contexts/envi-grou-noag | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to soil > Emissions to non-agricultural soil |
| 158,070 | default_context_mapping | context | — | {"dimension":"Environmental","media":"Air","strata":"Aircraft cruise height"} | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to air > Emissions to lower stratosphere and upper troposphere |
| 158,071 | default_context_mapping | context_iri | — | https://vocab.brightway.one/flow-contexts/envi-air-aicrhe | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to air > Emissions to lower stratosphere and upper troposphere |
| 166,372 | 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 |
| 166,373 | 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 |
| 175,268 | default_context_mapping | context | — | {"dimension":"Environmental","media":"Water","water_body":"Ocean"} | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to water > Emissions to sea water |
| 175,269 | default_context_mapping | context_iri | — | https://vocab.brightway.one/flow-contexts/envi-wate-ocea | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to water > Emissions to sea water |
| 179,742 | default_context_mapping | context | — | {"dimension":"Environmental","media":"Air","strata":"Unknown"} | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to air > Emissions to air, unspecified |
| 179,743 | default_context_mapping | context_iri | — | https://vocab.brightway.one/flow-contexts/envi-air-unkn | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to air > Emissions to air, unspecified |
| 199,846 | 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) |
| 199,847 | 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) |
| 214,027 | unit_normalization | unit_iri | — | https://vocab.brightway.one/units/unit/KiloGM | Unit IRI set from normalization of 'kg' |
| 229,164 | enrich_references | properties | {} | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C7H2ClF3N2… | Added ChEBI/PubChem properties (chebi_ids=0, pubchem_cids=1) |
| 229,165 | enrich_references | skos_definition | — | [] | Merged ChEBI/PubChem definitions into skos:definition |
| 229,166 | enrich_references | references | [] | [{"@id":"http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J29.541H","provenance":{"prov:wasGeneratedBy":"enrich_referenc… | Added references with provenance; cas_numbers=['393-75-9']; matched_chebi_ids=[]; candidate_pubchem_cids=[9809, 694648, 71651107]; selected_pubchem_cids=[9809]; 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 |
| 248,888 | rdkit_pre_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C7H2ClF3N2… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C7H2ClF3N2… | rdkit_pre_consensus from 'C1=C(C=C(C(=C1[N+](=O)[O-])Cl)[N+](=O)[O-])C(F)(F)F'; added: molecular_mass, monoisotopic_mass |
| 260,628 | consensus_match | altLabel | [] | [{"@value":"1,3-Dinitro-2-chloro-5-(trifluoromethyl)benzene","@language":"en","source":{"prov:wasGeneratedBy":"consensu… | group_key=2-chloro-1,3-dinitro-5-(trifluoromethyl)benzene||dimension=Environmental > media=Air > indoor=Unknown; cas=393-75-9; added Common Chemistry CAS names as altLabel: 1,3-Dinitro-2-chloro-5-(trifluoromethyl)benzene, 1-Chloro-2,6-dinitro-4-(trifluoromethyl)benzene, 2,6-Dinitro-4-(trifluoromethyl)chlorobenzene, 3,5-Dinitro-4-chlorobenzotrifluoride, 3,5-Dinitro-4-chlorotrifluoromethylbenzene, 4-(Trifluoromethyl)-2,6-dinitrochlorobenzene, 4-Chloro-3,5-dinitro-α,α,α-trifluorotoluene, 4-Chloro-3,5-dinitrobenzotrifluoride, 4-Chloro-α,α,α-trifluoro-3,5-dinitrotoluene, Benzene, 2-chloro-1,3-dinitro-5-(trifluoromethyl)-, Chloralin, NSC 88274, Toluene, 4-chloro-α,α,α-trifluoro-3,5-dinitro-; object_uuid=fo-cab8945cc1ecde98 |
| 260,629 | consensus_match | cas_match_labels | — | {"393-75-9":"exactMatch"} | group_key=2-chloro-1,3-dinitro-5-(trifluoromethyl)benzene||dimension=Environmental > media=Air > indoor=Unknown; group_sources=['ec_inventory', 'pubchem']; cas_sources={'393-75-9': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-cab8945cc1ecde98: {'393-75-9': 'exactMatch'} |
| 274,007 | opsin_iupac | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C7H2ClF3N2… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C7H2ClF3N2… | opsin_iupac: set authoritative IUPAC name, SMILES, InChI from '2-chloro-1,3-dinitro-5-(trifluoromethyl)benzene' |
| 280,408 | rdkit_post_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C7H2ClF3N2… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C7H2ClF3N2… | rdkit_post_consensus from 'O=[N+]([O-])c1cc(C(F)(F)F)cc([N+](=O)[O-])c1Cl'; confirmed: smiles_string, inchi2d_string, inchi2d_key_string, molecular_formula, molecular_mass, monoisotopic_mass |
| 287,658 | strip_catalogue_altlabels | altLabel | [{"@value":"1,3-Dinitro-2-chloro-5-(trifluoromethyl)benzene","@language":"en","source":{"prov:wasGeneratedBy":"consensu… | [{"@value":"1,3-Dinitro-2-chloro-5-(trifluoromethyl)benzene","@language":"en","source":{"prov:wasGeneratedBy":"consensu… | Removed 1 catalogue altLabel value(s): 'NSC 88274' (registry code) |
| 294,714 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/0287f8d2-3d7e-… | associations resolved on the elementary layer |
| 303,902 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/0e3ce1b4-6226-… | associations resolved on the elementary layer |
| 311,165 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/23a3b759-d0b6-… | associations resolved on the elementary layer |
| 311,238 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/23e87c16-e81a-… | associations resolved on the elementary layer |
| 316,773 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/33f4714c-ff29-… | associations resolved on the elementary layer |
| 322,749 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/46ed6dd7-e114-… | associations resolved on the elementary layer |
| 323,169 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/486ce6b3-6337-… | associations resolved on the elementary layer |
| 343,603 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/7ed32ade-5acc-… | associations resolved on the elementary layer |
| 360,052 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/b6623462-9bcd-… | associations resolved on the elementary layer |
| 364,205 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/c4de5802-5b4d-… | associations resolved on the elementary layer |
| 368,651 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/d3de40a7-1b74-… | associations resolved on the elementary layer |