4-bromophenyl Acetate
Everything that changed this flow. Back to the flow
07f80de6-dbb1-481d-8a45-9ecb94f45668
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 1 catalogue altLabel value(s): 'NSC 404083' (registry code) |
| 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=4-bromophenylacetate||dimension=Environmental > media=Air > strata=Long-term; group_sources=['ec_inventory', 'pubchem']; cas_sources={'1927-95-3': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-6193ab20b01f5e19: {'1927-95-3': '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 air, unspecified (long-term) |
| context_iri | 1 | default_context_mapping | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to air > Emissions to air, unspecified (long-term) |
| name | 1 | bootstrap_labels | Purged legacy name field to enforce prefLabel usage |
| references | 1 | enrich_references | Added references with provenance; cas_numbers=['1927-95-3']; matched_chebi_ids=[]; candidate_pubchem_cids=[74654, 74726, 190835, 45792032, 56924024]; selected_pubchem_cids=[74726]; 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 |
|---|---|---|---|---|---|
| 6,326 | bootstrap_labels | prefLabel | — | [{"@value":"4-bromophenyl acetate","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:wasAttribu… | Bootstrapped prefLabel from legacy name field |
| 6,327 | bootstrap_labels | name | 4-bromophenyl acetate | — | Purged legacy name field to enforce prefLabel usage |
| 6,328 | bootstrap_labels | synonyms | ["organic","4-bromophenylacetate"] | [] | Removed legacy synonyms field in favor of structured labels |
| 31,480 | 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) |
| 31,481 | 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) |
| 215,453 | unit_normalization | unit_iri | — | https://vocab.brightway.one/units/unit/KiloGM | Unit IRI set from normalization of 'kg' |
| 222,549 | normalize_name_case | prefLabel | [{"@value":"4-bromophenyl acetate","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:wasAttribu… | [{"@value":"4-bromophenyl Acetate","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:wasAttribu… | Title-cased words without internal capitals (preserved words with uppercase letters beyond the first character) |
| 233,260 | enrich_references | properties | {} | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C8H7BrO2"]… | Added ChEBI/PubChem properties (chebi_ids=0, pubchem_cids=1) |
| 233,261 | enrich_references | skos_definition | — | [] | Merged ChEBI/PubChem definitions into skos:definition |
| 233,262 | enrich_references | references | [] | [{"@id":"http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J122.290B","provenance":{"prov:wasGeneratedBy":"enrich_referen… | Added references with provenance; cas_numbers=['1927-95-3']; matched_chebi_ids=[]; candidate_pubchem_cids=[74654, 74726, 190835, 45792032, 56924024]; selected_pubchem_cids=[74726]; 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 |
| 250,067 | rdkit_pre_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C8H7BrO2"]… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C8H7BrO2"]… | rdkit_pre_consensus from 'CC(=O)OC1=CC=C(C=C1)Br'; added: molecular_mass, monoisotopic_mass |
| 262,604 | consensus_match | altLabel | [] | [{"@value":"1-Acetoxy-4-bromobenzene","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttri… | group_key=4-bromophenylacetate||dimension=Environmental > media=Air > strata=Long-term; cas=1927-95-3; added Common Chemistry CAS names as altLabel: 1-Acetoxy-4-bromobenzene, 1-Bromo-4-acetoxybenzene, 4-Acetoxybromobenzene, 4-Bromoacetoxybenzene, 4-Bromophenol acetate, <em>p</em>-Acetoxybromobenzene, <em>p</em>-Bromophenyl acetate, NSC 404083, Phenol, 4-bromo-, 1-acetate, Phenol, 4-bromo-, acetate, Phenol, <em>p</em>-bromo-, acetate; object_uuid=fo-6193ab20b01f5e19 |
| 262,605 | consensus_match | cas_match_labels | — | {"1927-95-3":"exactMatch"} | group_key=4-bromophenylacetate||dimension=Environmental > media=Air > strata=Long-term; group_sources=['ec_inventory', 'pubchem']; cas_sources={'1927-95-3': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-6193ab20b01f5e19: {'1927-95-3': 'exactMatch'} |
| 275,206 | opsin_iupac | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C8H7BrO2"]… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C8H7BrO2"]… | opsin_iupac: set authoritative IUPAC name, SMILES, InChI from '4-bromophenyl Acetate' |
| 281,706 | rdkit_post_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C8H7BrO2"]… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C8H7BrO2"]… | rdkit_post_consensus from 'CC(=O)Oc1ccc(Br)cc1'; confirmed: smiles_string, inchi2d_string, inchi2d_key_string, molecular_formula, molecular_mass, monoisotopic_mass |
| 288,543 | strip_catalogue_altlabels | altLabel | [{"@value":"1-Acetoxy-4-bromobenzene","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttri… | [{"@value":"1-Acetoxy-4-bromobenzene","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttri… | Removed 1 catalogue altLabel value(s): 'NSC 404083' (registry code) |
| 296,779 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/07f80de6-dbb1-… | associations resolved on the elementary layer |
| 389,508 | normalise_property_values | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C8H7BrO2"]… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C8H7BrO2"]… | typed the way the ontology types it |
| 396,696 | 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/20260821T1554374006150000/6326 | prefLabel | ef:agent/bootstrap_labels | ef:flow/07f80de6-dbb1-481d-8a45-9ecb94f45668/v0 | ef:flow/07f80de6-dbb1-481d-8a45-9ecb94f45668/v1 |
| ef:activity/change/20260821T1554374006150000/6327 | name | ef:agent/bootstrap_labels | ef:flow/07f80de6-dbb1-481d-8a45-9ecb94f45668/v1 | ef:flow/07f80de6-dbb1-481d-8a45-9ecb94f45668/v2 |
| ef:activity/change/20260821T1554374006150000/6328 | synonyms | ef:agent/bootstrap_labels | ef:flow/07f80de6-dbb1-481d-8a45-9ecb94f45668/v2 | ef:flow/07f80de6-dbb1-481d-8a45-9ecb94f45668/v3 |
| ef:activity/change/20260821T1554374006150000/31480 | context | ef:agent/default_context_mapping | ef:flow/07f80de6-dbb1-481d-8a45-9ecb94f45668/v3 | ef:flow/07f80de6-dbb1-481d-8a45-9ecb94f45668/v4 |
| ef:activity/change/20260821T1554374006150000/31481 | context_iri | ef:agent/default_context_mapping | ef:flow/07f80de6-dbb1-481d-8a45-9ecb94f45668/v4 | ef:flow/07f80de6-dbb1-481d-8a45-9ecb94f45668/v5 |
| ef:activity/change/20260821T1554374006150000/215453 | unit_iri | ef:agent/unit_normalization | ef:flow/07f80de6-dbb1-481d-8a45-9ecb94f45668/v5 | ef:flow/07f80de6-dbb1-481d-8a45-9ecb94f45668/v6 |
| ef:activity/change/20260821T1554374006150000/222549 | prefLabel | ef:agent/normalize_name_case | ef:flow/07f80de6-dbb1-481d-8a45-9ecb94f45668/v6 | ef:flow/07f80de6-dbb1-481d-8a45-9ecb94f45668/v7 |
| ef:activity/change/20260821T1554374006150000/233260 | properties | ef:agent/enrich_references | ef:flow/07f80de6-dbb1-481d-8a45-9ecb94f45668/v7 | ef:flow/07f80de6-dbb1-481d-8a45-9ecb94f45668/v8 |
| ef:activity/change/20260821T1554374006150000/233261 | skos_definition | ef:agent/enrich_references | ef:flow/07f80de6-dbb1-481d-8a45-9ecb94f45668/v8 | ef:flow/07f80de6-dbb1-481d-8a45-9ecb94f45668/v9 |
| ef:activity/change/20260821T1554374006150000/233262 | references | ef:agent/enrich_references | ef:flow/07f80de6-dbb1-481d-8a45-9ecb94f45668/v9 | ef:flow/07f80de6-dbb1-481d-8a45-9ecb94f45668/v10 |
| ef:activity/change/20260821T1554374006150000/250067 | properties | ef:agent/rdkit_pre_consensus | ef:flow/07f80de6-dbb1-481d-8a45-9ecb94f45668/v10 | ef:flow/07f80de6-dbb1-481d-8a45-9ecb94f45668/v11 |
| ef:activity/change/20260821T1554374006150000/262604 | altLabel | ef:agent/consensus_match | ef:flow/07f80de6-dbb1-481d-8a45-9ecb94f45668/v11 | ef:flow/07f80de6-dbb1-481d-8a45-9ecb94f45668/v12 |
| ef:activity/change/20260821T1554374006150000/262605 | cas_match_labels | ef:agent/consensus_match | ef:flow/07f80de6-dbb1-481d-8a45-9ecb94f45668/v12 | ef:flow/07f80de6-dbb1-481d-8a45-9ecb94f45668/v13 |
| ef:activity/change/20260821T1554374006150000/275206 | properties | ef:agent/opsin_iupac | ef:flow/07f80de6-dbb1-481d-8a45-9ecb94f45668/v13 | ef:flow/07f80de6-dbb1-481d-8a45-9ecb94f45668/v14 |
| ef:activity/change/20260821T1554374006150000/281706 | properties | ef:agent/rdkit_post_consensus | ef:flow/07f80de6-dbb1-481d-8a45-9ecb94f45668/v14 | ef:flow/07f80de6-dbb1-481d-8a45-9ecb94f45668/v15 |
| ef:activity/change/20260821T1554374006150000/288543 | altLabel | ef:agent/strip_catalogue_altlabels | ef:flow/07f80de6-dbb1-481d-8a45-9ecb94f45668/v15 | ef:flow/07f80de6-dbb1-481d-8a45-9ecb94f45668/v16 |
| ef:activity/change/20260821T1554374006150000/296779 | concept_associations | ef:agent/carry_associations_onto_flows | ef:flow/07f80de6-dbb1-481d-8a45-9ecb94f45668/v16 | ef:flow/07f80de6-dbb1-481d-8a45-9ecb94f45668/v17 |
| ef:activity/change/20260821T1554374006150000/389508 | properties | ef:agent/normalise_property_values | ef:flow/07f80de6-dbb1-481d-8a45-9ecb94f45668/v17 | ef:flow/07f80de6-dbb1-481d-8a45-9ecb94f45668/v18 |
| ef:activity/change/20260821T1554374006150000/396696 | types | ef:agent/link_flows_to_their_substance | ef:flow/07f80de6-dbb1-481d-8a45-9ecb94f45668/v18 | ef:flow/07f80de6-dbb1-481d-8a45-9ecb94f45668/v19 |