3-ethoxy-1,1,1,2,3,4,4,5,5,6,6,6-dodecafluoro-2-(trifluoromethyl)-hexane
Everything that changed this flow. Back to the flow
7f863890-53f3-49c4-902b-ccc5e3365caf
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 2 catalogue altLabel value(s): 'HFE 7500' (grade code), 'Novec 7500' (trade name) |
| cas_match_labels | 1 | consensus_match | group_key=3-ethoxy-1,1,1,2,3,4,4,5,5,6,6,6-dodecafluoro-2-(trifluoromethyl)-hexane||dimension=Environmental > media=Air > strata=Aircraft cruise height; group_sources=['pubchem']; cas_sources={'297730-93-9': ['pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-455570e3d3972ea3: {'297730-93-9': '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 sea water |
| context_iri | 1 | default_context_mapping | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to water > Emissions to sea water |
| 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=['297730-93-9']; matched_chebi_ids=[]; candidate_pubchem_cids=[2782436, 97290755]; selected_pubchem_cids=[2782436]; 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 |
|---|---|---|---|---|---|
| 16,874 | bootstrap_labels | prefLabel | — | [{"@value":"3-ethoxy-1,1,1,2,3,4,4,5,5,6,6,6-dodecafluoro-2-(trifluoromethyl)-hexane","@language":"en","source":{"prov:… | Bootstrapped prefLabel from legacy name field |
| 16,875 | bootstrap_labels | name | 3-ethoxy-1,1,1,2,3,4,4,5,5,6,6,6-dodecafluoro-2-(trifluoromethyl)-hexane | — | Purged legacy name field to enforce prefLabel usage |
| 16,876 | bootstrap_labels | synonyms | ["organic","3-ethoxy-1,1,1,2,3,4,4,5,5,6,6,6-dodecafluoro-2-(trifluoromethyl)-hexane","hfe-7500engineeredfluid"] | [] | Removed legacy synonyms field in favor of structured labels |
| 125,656 | 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 |
| 125,657 | 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 |
| 218,880 | unit_normalization | unit_iri | — | https://vocab.brightway.one/units/unit/KiloGM | Unit IRI set from normalization of 'kg' |
| 243,041 | enrich_references | properties | {} | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C9H5F15O"]… | Added ChEBI/PubChem properties (chebi_ids=0, pubchem_cids=1) |
| 243,042 | enrich_references | skos_definition | — | [] | Merged ChEBI/PubChem definitions into skos:definition |
| 243,043 | enrich_references | references | [] | [{"@id":"http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J1.645.470B","provenance":{"prov:wasGeneratedBy":"enrich_refer… | Added references with provenance; cas_numbers=['297730-93-9']; matched_chebi_ids=[]; candidate_pubchem_cids=[2782436, 97290755]; selected_pubchem_cids=[2782436]; 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 |
| 252,891 | rdkit_pre_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C9H5F15O"]… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C9H5F15O"]… | rdkit_pre_consensus from 'CCOC(C(C(F)(F)F)(C(F)(F)F)F)(C(C(C(F)(F)F)(F)F)(F)F)F'; added: molecular_mass, monoisotopic_mass |
| 262,017 | consensus_match | altLabel | [] | [{"@value":"2-Trifluoromethyl-3-ethoxydodeca-fluorohexane","@language":"en","source":{"prov:wasGeneratedBy":"consensus_… | group_key=3-ethoxy-1,1,1,2,3,4,4,5,5,6,6,6-dodecafluoro-2-(trifluoromethyl)-hexane||dimension=Environmental > media=Air > strata=Aircraft cruise height; cas=297730-93-9; added Common Chemistry CAS names as altLabel: 2-Trifluoromethyl-3-ethoxydodeca-fluorohexane, 3-Ethoxy-1,1,1,2,3,4,4,5,5,6,6,6-dodecafluoro-2-(trifluoromethyl)hexane, 3-Ethoxyperfluoro(2-methylhexane), Fluo-Oil 7500, HFE 7500, Hexane, 3-ethoxy-1,1,1,2,3,4,4,5,5,6,6,6-dodecafluoro-2-(trifluoromethyl)-, Novec 7500, Novec Engineered Fluid HFE 7500, Novec HFE 7500; object_uuid=fo-455570e3d3972ea3 |
| 262,018 | consensus_match | cas_match_labels | — | {"297730-93-9":"exactMatch"} | group_key=3-ethoxy-1,1,1,2,3,4,4,5,5,6,6,6-dodecafluoro-2-(trifluoromethyl)-hexane||dimension=Environmental > media=Air > strata=Aircraft cruise height; group_sources=['pubchem']; cas_sources={'297730-93-9': ['pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-455570e3d3972ea3: {'297730-93-9': 'exactMatch'} |
| 278,110 | opsin_iupac | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C9H5F15O"]… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C9H5F15O"]… | opsin_iupac: set authoritative IUPAC name, SMILES, InChI from '3-ethoxy-1,1,1,2,3,4,4,5,5,6,6,6-dodecafluoro-2-(trifluoromethyl)-hexane' |
| 284,844 | rdkit_post_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C9H5F15O"]… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C9H5F15O"]… | rdkit_post_consensus from 'CCOC(F)(C(F)(F)C(F)(F)C(F)(F)F)C(F)(C(F)(F)F)C(F)(F)F'; confirmed: smiles_string, inchi2d_string, inchi2d_key_string, molecular_formula, molecular_mass, monoisotopic_mass |
| 290,704 | strip_catalogue_altlabels | altLabel | [{"@value":"2-Trifluoromethyl-3-ethoxydodeca-fluorohexane","@language":"en","source":{"prov:wasGeneratedBy":"consensus_… | [{"@value":"2-Trifluoromethyl-3-ethoxydodeca-fluorohexane","@language":"en","source":{"prov:wasGeneratedBy":"consensus_… | Removed 2 catalogue altLabel value(s): 'HFE 7500' (grade code), 'Novec 7500' (trade name) |
| 343,850 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/7f863890-53f3-… | associations resolved on the elementary layer |
| 392,465 | normalise_property_values | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C9H5F15O"]… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C9H5F15O"]… | typed the way the ontology types it |
| 400,941 | 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/20260820T0738569779880000/16874 | prefLabel | ef:agent/bootstrap_labels | ef:flow/7f863890-53f3-49c4-902b-ccc5e3365caf/v0 | ef:flow/7f863890-53f3-49c4-902b-ccc5e3365caf/v1 |
| ef:activity/change/20260820T0738569779880000/16875 | name | ef:agent/bootstrap_labels | ef:flow/7f863890-53f3-49c4-902b-ccc5e3365caf/v1 | ef:flow/7f863890-53f3-49c4-902b-ccc5e3365caf/v2 |
| ef:activity/change/20260820T0738569779880000/16876 | synonyms | ef:agent/bootstrap_labels | ef:flow/7f863890-53f3-49c4-902b-ccc5e3365caf/v2 | ef:flow/7f863890-53f3-49c4-902b-ccc5e3365caf/v3 |
| ef:activity/change/20260820T0738569779880000/125656 | context | ef:agent/default_context_mapping | ef:flow/7f863890-53f3-49c4-902b-ccc5e3365caf/v3 | ef:flow/7f863890-53f3-49c4-902b-ccc5e3365caf/v4 |
| ef:activity/change/20260820T0738569779880000/125657 | context_iri | ef:agent/default_context_mapping | ef:flow/7f863890-53f3-49c4-902b-ccc5e3365caf/v4 | ef:flow/7f863890-53f3-49c4-902b-ccc5e3365caf/v5 |
| ef:activity/change/20260820T0738569779880000/218880 | unit_iri | ef:agent/unit_normalization | ef:flow/7f863890-53f3-49c4-902b-ccc5e3365caf/v5 | ef:flow/7f863890-53f3-49c4-902b-ccc5e3365caf/v6 |
| ef:activity/change/20260820T0738569779880000/243041 | properties | ef:agent/enrich_references | ef:flow/7f863890-53f3-49c4-902b-ccc5e3365caf/v6 | ef:flow/7f863890-53f3-49c4-902b-ccc5e3365caf/v7 |
| ef:activity/change/20260820T0738569779880000/243042 | skos_definition | ef:agent/enrich_references | ef:flow/7f863890-53f3-49c4-902b-ccc5e3365caf/v7 | ef:flow/7f863890-53f3-49c4-902b-ccc5e3365caf/v8 |
| ef:activity/change/20260820T0738569779880000/243043 | references | ef:agent/enrich_references | ef:flow/7f863890-53f3-49c4-902b-ccc5e3365caf/v8 | ef:flow/7f863890-53f3-49c4-902b-ccc5e3365caf/v9 |
| ef:activity/change/20260820T0738569779880000/252891 | properties | ef:agent/rdkit_pre_consensus | ef:flow/7f863890-53f3-49c4-902b-ccc5e3365caf/v9 | ef:flow/7f863890-53f3-49c4-902b-ccc5e3365caf/v10 |
| ef:activity/change/20260820T0738569779880000/262017 | altLabel | ef:agent/consensus_match | ef:flow/7f863890-53f3-49c4-902b-ccc5e3365caf/v10 | ef:flow/7f863890-53f3-49c4-902b-ccc5e3365caf/v11 |
| ef:activity/change/20260820T0738569779880000/262018 | cas_match_labels | ef:agent/consensus_match | ef:flow/7f863890-53f3-49c4-902b-ccc5e3365caf/v11 | ef:flow/7f863890-53f3-49c4-902b-ccc5e3365caf/v12 |
| ef:activity/change/20260820T0738569779880000/278110 | properties | ef:agent/opsin_iupac | ef:flow/7f863890-53f3-49c4-902b-ccc5e3365caf/v12 | ef:flow/7f863890-53f3-49c4-902b-ccc5e3365caf/v13 |
| ef:activity/change/20260820T0738569779880000/284844 | properties | ef:agent/rdkit_post_consensus | ef:flow/7f863890-53f3-49c4-902b-ccc5e3365caf/v13 | ef:flow/7f863890-53f3-49c4-902b-ccc5e3365caf/v14 |
| ef:activity/change/20260820T0738569779880000/290704 | altLabel | ef:agent/strip_catalogue_altlabels | ef:flow/7f863890-53f3-49c4-902b-ccc5e3365caf/v14 | ef:flow/7f863890-53f3-49c4-902b-ccc5e3365caf/v15 |
| ef:activity/change/20260820T0738569779880000/343850 | concept_associations | ef:agent/carry_associations_onto_flows | ef:flow/7f863890-53f3-49c4-902b-ccc5e3365caf/v15 | ef:flow/7f863890-53f3-49c4-902b-ccc5e3365caf/v16 |
| ef:activity/change/20260820T0738569779880000/392465 | properties | ef:agent/normalise_property_values | ef:flow/7f863890-53f3-49c4-902b-ccc5e3365caf/v16 | ef:flow/7f863890-53f3-49c4-902b-ccc5e3365caf/v17 |
| ef:activity/change/20260820T0738569779880000/400941 | types | ef:agent/link_flows_to_their_substance | ef:flow/7f863890-53f3-49c4-902b-ccc5e3365caf/v17 | ef:flow/7f863890-53f3-49c4-902b-ccc5e3365caf/v18 |