4-chlorobutanoyl Chloride
Everything that changed this flow. Back to the flow
5842ea92-75a8-42a5-acf9-44eaf1cc5130
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 |
| prefLabel | 2 | bootstrap_labels, normalize_name_case | Title-cased words without internal capitals (preserved words with uppercase letters beyond the first character) |
| altLabel | 1 | consensus_match | group_key=4-chlorobutanoylchloride||dimension=Environmental > media=Air > strata=Unknown; cas=4635-59-0; added Common Chemistry CAS names as altLabel: 4-Chlorobutanoic acid chloride, 4-Chlorobutyric acid chloride, 4-Chlorobutyroyl chloride, 4-Chlorobutyryl chloride, Butanoyl chloride, 4-chloro-, Butyryl chloride, 4-chloro-, γ-Chlorobutyroyl chloride, γ-Chlorobutyryl chloride, ω-Chlorobutanoyl chloride, ω-Chlorobutyryl chloride; object_uuid=fo-7cbf4b40472d9daa |
| cas_match_labels | 1 | consensus_match | group_key=4-chlorobutanoylchloride||dimension=Environmental > media=Air > strata=Unknown; group_sources=['ec_inventory', 'pubchem']; cas_sources={'4635-59-0': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-7cbf4b40472d9daa: {'4635-59-0': '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, indoor |
| context_iri | 1 | default_context_mapping | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to air > Emissions to air, indoor |
| name | 1 | bootstrap_labels | Purged legacy name field to enforce prefLabel usage |
| references | 1 | enrich_references | Added references with provenance; cas_numbers=['4635-59-0']; matched_chebi_ids=[]; candidate_pubchem_cids=[77966, 78370, 53421306]; selected_pubchem_cids=[78370]; 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 |
|---|---|---|---|---|---|
| 16,306 | bootstrap_labels | prefLabel | — | [{"@value":"4-chlorobutanoyl chloride","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:wasAtt… | Bootstrapped prefLabel from legacy name field |
| 16,307 | bootstrap_labels | name | 4-chlorobutanoyl chloride | — | Purged legacy name field to enforce prefLabel usage |
| 16,308 | bootstrap_labels | synonyms | ["organic","4-chlorobutyrylchloride",".gamma.-chlorobutyroylchloride",".gamma.-chlorobutyrylchloride",".omega.-chlorobu… | [] | Removed legacy synonyms field in favor of structured labels |
| 102,228 | 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 |
| 102,229 | 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 |
| 218,691 | unit_normalization | unit_iri | — | https://vocab.brightway.one/units/unit/KiloGM | Unit IRI set from normalization of 'kg' |
| 224,835 | normalize_name_case | prefLabel | [{"@value":"4-chlorobutanoyl chloride","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:wasAtt… | [{"@value":"4-chlorobutanoyl Chloride","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:wasAtt… | Title-cased words without internal capitals (preserved words with uppercase letters beyond the first character) |
| 242,516 | enrich_references | properties | {} | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C4H6Cl2O"]… | Added ChEBI/PubChem properties (chebi_ids=0, pubchem_cids=1) |
| 242,517 | enrich_references | skos_definition | — | [] | Merged ChEBI/PubChem definitions into skos:definition |
| 242,518 | enrich_references | references | [] | [{"@id":"http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J26.724D","provenance":{"prov:wasGeneratedBy":"enrich_referenc… | Added references with provenance; cas_numbers=['4635-59-0']; matched_chebi_ids=[]; candidate_pubchem_cids=[77966, 78370, 53421306]; selected_pubchem_cids=[78370]; 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 |
| 252,740 | rdkit_pre_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C4H6Cl2O"]… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C4H6Cl2O"]… | rdkit_pre_consensus from 'C(CC(=O)Cl)CCl'; added: molecular_mass, monoisotopic_mass |
| 262,670 | consensus_match | altLabel | [] | [{"@value":"4-Chlorobutanoic acid chloride","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wa… | group_key=4-chlorobutanoylchloride||dimension=Environmental > media=Air > strata=Unknown; cas=4635-59-0; added Common Chemistry CAS names as altLabel: 4-Chlorobutanoic acid chloride, 4-Chlorobutyric acid chloride, 4-Chlorobutyroyl chloride, 4-Chlorobutyryl chloride, Butanoyl chloride, 4-chloro-, Butyryl chloride, 4-chloro-, γ-Chlorobutyroyl chloride, γ-Chlorobutyryl chloride, ω-Chlorobutanoyl chloride, ω-Chlorobutyryl chloride; object_uuid=fo-7cbf4b40472d9daa |
| 262,671 | consensus_match | cas_match_labels | — | {"4635-59-0":"exactMatch"} | group_key=4-chlorobutanoylchloride||dimension=Environmental > media=Air > strata=Unknown; group_sources=['ec_inventory', 'pubchem']; cas_sources={'4635-59-0': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-7cbf4b40472d9daa: {'4635-59-0': 'exactMatch'} |
| 277,946 | opsin_iupac | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C4H6Cl2O"]… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C4H6Cl2O"]… | opsin_iupac: set authoritative IUPAC name, SMILES, InChI from '4-chlorobutanoyl Chloride' |
| 284,662 | rdkit_post_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C4H6Cl2O"]… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C4H6Cl2O"]… | rdkit_post_consensus from 'O=C(Cl)CCCCl'; confirmed: smiles_string, inchi2d_string, inchi2d_key_string, molecular_formula, molecular_mass, monoisotopic_mass |
| 332,111 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/5842ea92-75a8-… | associations resolved on the elementary layer |
| 392,295 | normalise_property_values | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C4H6Cl2O"]… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C4H6Cl2O"]… | typed the way the ontology types it |
| 400,692 | 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/20260821T1554374006150000/16306 | prefLabel | ef:agent/bootstrap_labels | ef:flow/5842ea92-75a8-42a5-acf9-44eaf1cc5130/v0 | ef:flow/5842ea92-75a8-42a5-acf9-44eaf1cc5130/v1 |
| ef:activity/change/20260821T1554374006150000/16307 | name | ef:agent/bootstrap_labels | ef:flow/5842ea92-75a8-42a5-acf9-44eaf1cc5130/v1 | ef:flow/5842ea92-75a8-42a5-acf9-44eaf1cc5130/v2 |
| ef:activity/change/20260821T1554374006150000/16308 | synonyms | ef:agent/bootstrap_labels | ef:flow/5842ea92-75a8-42a5-acf9-44eaf1cc5130/v2 | ef:flow/5842ea92-75a8-42a5-acf9-44eaf1cc5130/v3 |
| ef:activity/change/20260821T1554374006150000/102228 | context | ef:agent/default_context_mapping | ef:flow/5842ea92-75a8-42a5-acf9-44eaf1cc5130/v3 | ef:flow/5842ea92-75a8-42a5-acf9-44eaf1cc5130/v4 |
| ef:activity/change/20260821T1554374006150000/102229 | context_iri | ef:agent/default_context_mapping | ef:flow/5842ea92-75a8-42a5-acf9-44eaf1cc5130/v4 | ef:flow/5842ea92-75a8-42a5-acf9-44eaf1cc5130/v5 |
| ef:activity/change/20260821T1554374006150000/218691 | unit_iri | ef:agent/unit_normalization | ef:flow/5842ea92-75a8-42a5-acf9-44eaf1cc5130/v5 | ef:flow/5842ea92-75a8-42a5-acf9-44eaf1cc5130/v6 |
| ef:activity/change/20260821T1554374006150000/224835 | prefLabel | ef:agent/normalize_name_case | ef:flow/5842ea92-75a8-42a5-acf9-44eaf1cc5130/v6 | ef:flow/5842ea92-75a8-42a5-acf9-44eaf1cc5130/v7 |
| ef:activity/change/20260821T1554374006150000/242516 | properties | ef:agent/enrich_references | ef:flow/5842ea92-75a8-42a5-acf9-44eaf1cc5130/v7 | ef:flow/5842ea92-75a8-42a5-acf9-44eaf1cc5130/v8 |
| ef:activity/change/20260821T1554374006150000/242517 | skos_definition | ef:agent/enrich_references | ef:flow/5842ea92-75a8-42a5-acf9-44eaf1cc5130/v8 | ef:flow/5842ea92-75a8-42a5-acf9-44eaf1cc5130/v9 |
| ef:activity/change/20260821T1554374006150000/242518 | references | ef:agent/enrich_references | ef:flow/5842ea92-75a8-42a5-acf9-44eaf1cc5130/v9 | ef:flow/5842ea92-75a8-42a5-acf9-44eaf1cc5130/v10 |
| ef:activity/change/20260821T1554374006150000/252740 | properties | ef:agent/rdkit_pre_consensus | ef:flow/5842ea92-75a8-42a5-acf9-44eaf1cc5130/v10 | ef:flow/5842ea92-75a8-42a5-acf9-44eaf1cc5130/v11 |
| ef:activity/change/20260821T1554374006150000/262670 | altLabel | ef:agent/consensus_match | ef:flow/5842ea92-75a8-42a5-acf9-44eaf1cc5130/v11 | ef:flow/5842ea92-75a8-42a5-acf9-44eaf1cc5130/v12 |
| ef:activity/change/20260821T1554374006150000/262671 | cas_match_labels | ef:agent/consensus_match | ef:flow/5842ea92-75a8-42a5-acf9-44eaf1cc5130/v12 | ef:flow/5842ea92-75a8-42a5-acf9-44eaf1cc5130/v13 |
| ef:activity/change/20260821T1554374006150000/277946 | properties | ef:agent/opsin_iupac | ef:flow/5842ea92-75a8-42a5-acf9-44eaf1cc5130/v13 | ef:flow/5842ea92-75a8-42a5-acf9-44eaf1cc5130/v14 |
| ef:activity/change/20260821T1554374006150000/284662 | properties | ef:agent/rdkit_post_consensus | ef:flow/5842ea92-75a8-42a5-acf9-44eaf1cc5130/v14 | ef:flow/5842ea92-75a8-42a5-acf9-44eaf1cc5130/v15 |
| ef:activity/change/20260821T1554374006150000/332111 | concept_associations | ef:agent/carry_associations_onto_flows | ef:flow/5842ea92-75a8-42a5-acf9-44eaf1cc5130/v15 | ef:flow/5842ea92-75a8-42a5-acf9-44eaf1cc5130/v16 |
| ef:activity/change/20260821T1554374006150000/392295 | properties | ef:agent/normalise_property_values | ef:flow/5842ea92-75a8-42a5-acf9-44eaf1cc5130/v16 | ef:flow/5842ea92-75a8-42a5-acf9-44eaf1cc5130/v17 |
| ef:activity/change/20260821T1554374006150000/400692 | types | ef:agent/link_flows_to_their_substance | ef:flow/5842ea92-75a8-42a5-acf9-44eaf1cc5130/v17 | ef:flow/5842ea92-75a8-42a5-acf9-44eaf1cc5130/v18 |