Titanium Tetrakis(butan-1-olato)
Everything that changed this flow. Back to the flow
0d5debed-dc5c-4f56-992c-f58fb05defea
By field
13 fields| Field | Changes | Written by | Latest note |
|---|---|---|---|
| properties | 6 | enrich_references, normalise_property_values, opsin_iupac, rdkit_post_consensus, rdkit_pre_consensus, withhold_contradicted_composition | typed the way the ontology types it |
| altLabel | 2 | consensus_match, strip_catalogue_altlabels | Removed 7 catalogue altLabel value(s): 'AKT 850' (grade code), 'B 1' (grade code), 'D 25' (grade code), 'D 25 (curing accelerator)' (grade code), 'TA 21' (grade code), 'TA 25' (grade code), 'TBT 100' (grade 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=titaniumtetrakis(butan-1-olato)||dimension=Environmental > media=Water > water_body=Long-term; group_sources=['ec_inventory']; cas_sources={'5593-70-4': ['ec_inventory']}; assigned CAS labels from group consensus; object_uuid=fo-bf5d21fd4d9fcc2a: {'5593-70-4': '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 water, unspecified (long-term) |
| context_iri | 1 | default_context_mapping | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to water > Emissions to water, 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=['5593-70-4']; matched_chebi_ids=[]; candidate_pubchem_cids=[263, 21801, 521701, 25200196, 25203927, 73357421]; selected_pubchem_cids=[25200196]; 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
20| # | Step | Field | From | To | Why |
|---|---|---|---|---|---|
| 11,493 | bootstrap_labels | prefLabel | — | [{"@value":"titanium tetrakis(butan-1-olato)","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov… | Bootstrapped prefLabel from legacy name field |
| 11,494 | bootstrap_labels | name | titanium tetrakis(butan-1-olato) | — | Purged legacy name field to enforce prefLabel usage |
| 11,495 | bootstrap_labels | synonyms | ["organometallic","titaniumtetrabutanolate","insocat140","tytantbt","tytantnbt","tyzorbtm","tyzorâ®tnbt"] | [] | Removed legacy synonyms field in favor of structured labels |
| 44,340 | 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) |
| 44,341 | 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) |
| 217,150 | unit_normalization | unit_iri | — | https://vocab.brightway.one/units/unit/KiloGM | Unit IRI set from normalization of 'kg' |
| 223,773 | normalize_name_case | prefLabel | [{"@value":"titanium tetrakis(butan-1-olato)","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov… | [{"@value":"Titanium Tetrakis(butan-1-olato)","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov… | Title-cased words without internal capitals (preserved words with uppercase letters beyond the first character) |
| 238,115 | enrich_references | properties | {} | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C4H10OTi"]… | Added ChEBI/PubChem properties (chebi_ids=0, pubchem_cids=1) |
| 238,116 | enrich_references | skos_definition | — | [] | Merged ChEBI/PubChem definitions into skos:definition |
| 238,117 | enrich_references | references | [] | [{"@id":"https://commonchemistry.cas.org/detail?cas_rn=5593-70-4","provenance":{"prov:wasGeneratedBy":"enrich_reference… | Added references with provenance; cas_numbers=['5593-70-4']; matched_chebi_ids=[]; candidate_pubchem_cids=[263, 21801, 521701, 25200196, 25203927, 73357421]; selected_pubchem_cids=[25200196]; 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 |
| 251,459 | rdkit_pre_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C4H10OTi"]… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C4H10OTi"]… | rdkit_pre_consensus from 'CCCCO.[Ti]'; added: molecular_mass, monoisotopic_mass |
| 272,666 | consensus_match | altLabel | [] | [{"@value":"1-Butanol titanium salt (4:1)","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:was… | group_key=titaniumtetrakis(butan-1-olato)||dimension=Environmental > media=Water > water_body=Long-term; cas=5593-70-4; added Common Chemistry CAS names as altLabel: 1-Butanol titanium salt (4:1), 1-Butanol, titanium(4+) salt, 1-Butanol, titanium(4+) salt (4:1), <em>n</em>-Butanol titanium salt, <em>n</em>-Butyl titanate, AKT 850, B 1, Butyl alcohol, titanium(4+) salt, Butyl alcohol, titanium(4+) salt (4:1), Butyl orthotitanate, Butyl titanate(IV), Butyl titanate(IV) ((BuO)<sub>4</sub>Ti), Carbon titanium hydride hydroxide (C<sub>16</sub>TiH<sub>32</sub>(OH)<sub>4</sub>), D 25, D 25 (curing accelerator), Orgatix T 25, Orgatix TA 21, Orgatix TA 25, T 104104, T 818870, TA 21, TA 25, TBT, TBT 100, TBT-B 1, TNBT, Tegokat 1, Tetra-<em>n</em>-butoxytitanium, Tetra-<em>n</em>-butyl orthotitanate, Tetra-<em>n</em>-butyl titanate, Tetrabutoxytitanium, Tetrabutoxytitanium(IV), Tetrabutyl orthotitanate, Tetrabutyl titanate, Tetrabutyl titantate, Tetrakis(butanolato)titanium, Tilcom TNBT, Titanium <em>n</em>-butoxide, Titanium butoxide, Titanium butoxide (Ti(OBu)<sub>4</sub>), Titanium tetra-<em>n</em>-butoxide, Titanium tetra-<em>n</em>-butylate, Titanium tetrabutanolate, Titanium tetrabutoxide, Titanium tetrabutylate, Titanium tetrakis(1-butoxide), Titanium tetrakis(butoxide), Titanium(4+) butoxide, Titanium(IV) <em>n</em>-butoxide, Titanium(IV) butoxide, Titanium, tetrabutoxy-, Tizor TNBT, Tytan TNBT, Tyzor AC 446, Tyzor BTM, Tyzor TBT, Tyzor TNBT, Tyzor TNTB, Vertec TNBT; object_uuid=fo-bf5d21fd4d9fcc2a |
| 272,667 | consensus_match | cas_match_labels | — | {"5593-70-4":"exactMatch"} | group_key=titaniumtetrakis(butan-1-olato)||dimension=Environmental > media=Water > water_body=Long-term; group_sources=['ec_inventory']; cas_sources={'5593-70-4': ['ec_inventory']}; assigned CAS labels from group consensus; object_uuid=fo-bf5d21fd4d9fcc2a: {'5593-70-4': 'exactMatch'} |
| 276,638 | opsin_iupac | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C4H10OTi"]… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C4H10OTi"]… | opsin_iupac: set authoritative IUPAC name, SMILES, InChI from 'Tetra-n-butoxytitanium' |
| 283,263 | rdkit_post_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C4H10OTi"]… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C16H36O4Ti… | rdkit_post_consensus from 'CCCC[O][Ti]([O]CCCC)([O]CCCC)[O]CCCC'; added: inchi2d_key_string, molecular_formula, molecular_mass, monoisotopic_mass; confirmed: smiles_string, inchi2d_string |
| 286,674 | withhold_contradicted_composition | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C16H36O4Ti… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C16H36O4Ti… | withhold_contradicted_composition: the registry registers [(('C', 16), ('O', 4), ('Ti', 1))], contradicting ['C4H10OTi'] from ['enrich_references.pubchem_semantic']; withdrew inchi2d_key_string x1, molecular_formula x1 |
| 289,628 | strip_catalogue_altlabels | altLabel | [{"@value":"1-Butanol titanium salt (4:1)","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:was… | [{"@value":"1-Butanol titanium salt (4:1)","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:was… | Removed 7 catalogue altLabel value(s): 'AKT 850' (grade code), 'B 1' (grade code), 'D 25' (grade code), 'D 25 (curing accelerator)' (grade code), 'TA 21' (grade code), 'TA 25' (grade code), 'TBT 100' (grade code) |
| 303,196 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/0d5debed-dc5c-… | associations resolved on the elementary layer |
| 390,994 | normalise_property_values | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C16H36O4Ti… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C16H36O4Ti… | typed the way the ontology types it |
| 398,848 | link_flows_to_their_substance | types | — | ["https://w3id.org/chemrof/NeutralMolecule"] | the substance's answer, copied onto its flow |
PROV-O trail
20 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/20260821T1302361922970000/11493 | prefLabel | ef:agent/bootstrap_labels | ef:flow/0d5debed-dc5c-4f56-992c-f58fb05defea/v0 | ef:flow/0d5debed-dc5c-4f56-992c-f58fb05defea/v1 |
| ef:activity/change/20260821T1302361922970000/11494 | name | ef:agent/bootstrap_labels | ef:flow/0d5debed-dc5c-4f56-992c-f58fb05defea/v1 | ef:flow/0d5debed-dc5c-4f56-992c-f58fb05defea/v2 |
| ef:activity/change/20260821T1302361922970000/11495 | synonyms | ef:agent/bootstrap_labels | ef:flow/0d5debed-dc5c-4f56-992c-f58fb05defea/v2 | ef:flow/0d5debed-dc5c-4f56-992c-f58fb05defea/v3 |
| ef:activity/change/20260821T1302361922970000/44340 | context | ef:agent/default_context_mapping | ef:flow/0d5debed-dc5c-4f56-992c-f58fb05defea/v3 | ef:flow/0d5debed-dc5c-4f56-992c-f58fb05defea/v4 |
| ef:activity/change/20260821T1302361922970000/44341 | context_iri | ef:agent/default_context_mapping | ef:flow/0d5debed-dc5c-4f56-992c-f58fb05defea/v4 | ef:flow/0d5debed-dc5c-4f56-992c-f58fb05defea/v5 |
| ef:activity/change/20260821T1302361922970000/217150 | unit_iri | ef:agent/unit_normalization | ef:flow/0d5debed-dc5c-4f56-992c-f58fb05defea/v5 | ef:flow/0d5debed-dc5c-4f56-992c-f58fb05defea/v6 |
| ef:activity/change/20260821T1302361922970000/223773 | prefLabel | ef:agent/normalize_name_case | ef:flow/0d5debed-dc5c-4f56-992c-f58fb05defea/v6 | ef:flow/0d5debed-dc5c-4f56-992c-f58fb05defea/v7 |
| ef:activity/change/20260821T1302361922970000/238115 | properties | ef:agent/enrich_references | ef:flow/0d5debed-dc5c-4f56-992c-f58fb05defea/v7 | ef:flow/0d5debed-dc5c-4f56-992c-f58fb05defea/v8 |
| ef:activity/change/20260821T1302361922970000/238116 | skos_definition | ef:agent/enrich_references | ef:flow/0d5debed-dc5c-4f56-992c-f58fb05defea/v8 | ef:flow/0d5debed-dc5c-4f56-992c-f58fb05defea/v9 |
| ef:activity/change/20260821T1302361922970000/238117 | references | ef:agent/enrich_references | ef:flow/0d5debed-dc5c-4f56-992c-f58fb05defea/v9 | ef:flow/0d5debed-dc5c-4f56-992c-f58fb05defea/v10 |
| ef:activity/change/20260821T1302361922970000/251459 | properties | ef:agent/rdkit_pre_consensus | ef:flow/0d5debed-dc5c-4f56-992c-f58fb05defea/v10 | ef:flow/0d5debed-dc5c-4f56-992c-f58fb05defea/v11 |
| ef:activity/change/20260821T1302361922970000/272666 | altLabel | ef:agent/consensus_match | ef:flow/0d5debed-dc5c-4f56-992c-f58fb05defea/v11 | ef:flow/0d5debed-dc5c-4f56-992c-f58fb05defea/v12 |
| ef:activity/change/20260821T1302361922970000/272667 | cas_match_labels | ef:agent/consensus_match | ef:flow/0d5debed-dc5c-4f56-992c-f58fb05defea/v12 | ef:flow/0d5debed-dc5c-4f56-992c-f58fb05defea/v13 |
| ef:activity/change/20260821T1302361922970000/276638 | properties | ef:agent/opsin_iupac | ef:flow/0d5debed-dc5c-4f56-992c-f58fb05defea/v13 | ef:flow/0d5debed-dc5c-4f56-992c-f58fb05defea/v14 |
| ef:activity/change/20260821T1302361922970000/283263 | properties | ef:agent/rdkit_post_consensus | ef:flow/0d5debed-dc5c-4f56-992c-f58fb05defea/v14 | ef:flow/0d5debed-dc5c-4f56-992c-f58fb05defea/v15 |
| ef:activity/change/20260821T1302361922970000/286674 | properties | ef:agent/withhold_contradicted_composition | ef:flow/0d5debed-dc5c-4f56-992c-f58fb05defea/v15 | ef:flow/0d5debed-dc5c-4f56-992c-f58fb05defea/v16 |
| ef:activity/change/20260821T1302361922970000/289628 | altLabel | ef:agent/strip_catalogue_altlabels | ef:flow/0d5debed-dc5c-4f56-992c-f58fb05defea/v16 | ef:flow/0d5debed-dc5c-4f56-992c-f58fb05defea/v17 |
| ef:activity/change/20260821T1302361922970000/303196 | concept_associations | ef:agent/carry_associations_onto_flows | ef:flow/0d5debed-dc5c-4f56-992c-f58fb05defea/v17 | ef:flow/0d5debed-dc5c-4f56-992c-f58fb05defea/v18 |
| ef:activity/change/20260821T1302361922970000/390994 | properties | ef:agent/normalise_property_values | ef:flow/0d5debed-dc5c-4f56-992c-f58fb05defea/v18 | ef:flow/0d5debed-dc5c-4f56-992c-f58fb05defea/v19 |
| ef:activity/change/20260821T1302361922970000/398848 | types | ef:agent/link_flows_to_their_substance | ef:flow/0d5debed-dc5c-4f56-992c-f58fb05defea/v19 | ef:flow/0d5debed-dc5c-4f56-992c-f58fb05defea/v20 |