Bis(ethylacetoacetato‐o1',o3")bis(propan‐2‐olato)titanium
Everything that changed this flow. Back to the flow
633f2f82-682d-49ab-b81f-71d20745536d
By field
13 fields| Field | Changes | Written by | Latest note |
|---|---|---|---|
| properties | 4 | enrich_references, normalise_property_values, rdkit_post_consensus, rdkit_pre_consensus | typed the way the ontology types it |
| altLabel | 2 | consensus_match, strip_catalogue_altlabels | Removed 7 catalogue altLabel value(s): 'AKT 865' (grade code), 'CTC 754' (grade code), 'T 60' (grade code), 'T 60 (titanate)' (grade code), 'TC 710' (grade code), 'TC 750' (grade code), 'Tyzor 726' (trade name) |
| 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=bis(ethylacetoacetato‐o1',o3")bis(propan‐2‐olato)titanium||dimension=Environmental > media=Air > strata=Long-term; group_sources=['ec_inventory']; cas_sources={'27858-32-8': ['ec_inventory']}; assigned CAS labels from group consensus; object_uuid=fo-72ea33edbebf90b6: {'27858-32-8': '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 lower stratosphere and upper troposphere |
| context_iri | 1 | default_context_mapping | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to air > Emissions to lower stratosphere and upper troposphere |
| name | 1 | bootstrap_labels | Purged legacy name field to enforce prefLabel usage |
| references | 1 | enrich_references | Added references with provenance; cas_numbers=['27858-32-8']; matched_chebi_ids=[]; candidate_pubchem_cids=[161585, 21863414, 54692982, 60196424, 100991347, 121233044, 131852014, 136272714, 136636094, 137156391, 137248962, 137316213]; selected_pubchem_cids=[131852014]; 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 |
|---|---|---|---|---|---|
| 17,438 | bootstrap_labels | prefLabel | — | [{"@value":"bis(ethylacetoacetato‐o1',o3\")bis(propan‐2‐olato)titanium","@language":"en","source":{"prov:wasGeneratedBy… | Bootstrapped prefLabel from legacy name field |
| 17,439 | bootstrap_labels | name | bis(ethylacetoacetato‐o1',o3")bis(propan‐2‐olato)titanium | — | Purged legacy name field to enforce prefLabel usage |
| 17,440 | bootstrap_labels | synonyms | ["organometallic","bis(ethylacetoacetato-o1'",",o3)bis(propan-2-olato)titanium","tytans2","tyzorpita","tyzorâ®pita"] | [] | Removed legacy synonyms field in favor of structured labels |
| 108,694 | 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 |
| 108,695 | 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 |
| 219,056 | unit_normalization | unit_iri | — | https://vocab.brightway.one/units/unit/KiloGM | Unit IRI set from normalization of 'kg' |
| 225,085 | normalize_name_case | prefLabel | [{"@value":"bis(ethylacetoacetato‐o1',o3\")bis(propan‐2‐olato)titanium","@language":"en","source":{"prov:wasGeneratedBy… | [{"@value":"Bis(ethylacetoacetato‐o1',o3\")bis(propan‐2‐olato)titanium","@language":"en","source":{"prov:wasGeneratedBy… | Title-cased words without internal capitals (preserved words with uppercase letters beyond the first character) |
| 243,533 | enrich_references | properties | {} | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C18H32O8Ti… | Added ChEBI/PubChem properties (chebi_ids=0, pubchem_cids=1) |
| 243,534 | enrich_references | skos_definition | — | [] | Merged ChEBI/PubChem definitions into skos:definition |
| 243,535 | enrich_references | references | [] | [{"@id":"https://commonchemistry.cas.org/detail?cas_rn=27858-32-8","provenance":{"prov:wasGeneratedBy":"enrich_referenc… | Added references with provenance; cas_numbers=['27858-32-8']; matched_chebi_ids=[]; candidate_pubchem_cids=[161585, 21863414, 54692982, 60196424, 100991347, 121233044, 131852014, 136272714, 136636094, 137156391, 137248962, 137316213]; selected_pubchem_cids=[131852014]; 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 |
| 253,030 | rdkit_pre_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C18H32O8Ti… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C18H32O8Ti… | rdkit_pre_consensus from 'CCOC(=O)[CH-]C(=O)C.CCOC(=O)[CH-]C(=O)C.CC(C)[O-].CC(C)[O-].[Ti+4]'; added: molecular_mass, monoisotopic_mass |
| 264,370 | consensus_match | altLabel | [] | [{"@value":"2-Propanol, titanium complex","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasA… | group_key=bis(ethylacetoacetato‐o1',o3")bis(propan‐2‐olato)titanium||dimension=Environmental > media=Air > strata=Long-term; cas=27858-32-8; added Common Chemistry CAS names as altLabel: 2-Propanol, titanium complex, AKT 865, Bis(ethyl acetoacetato)diisopropoxytitanium, Bis[ethyl 3-(oxo-κ<em>O</em>)butanoato-κ<em>O</em>′]bis(2-propanolato)titanium, Butanoic acid, 3-oxo-, ethyl ester, titanium complex, CTC 754, Di(isopropoxy)bis(ethylacetoacetato)titanium, Diisopropoxy bis(ethyl acetoacetate)titanate, Diisopropoxytitanium bis(ethyl acetoacetate), Diisopropoxytitanium bis(ethyl acetylacetate), Orgatix TA 750, Orgatix TC 710, Orgatix TC 750, SR PITA, T 60, T 60 (titanate), TC 710, TC 750, TCA-DC, Tilcom KE 2, Titanium bis(ethyl acetoacetate) diisopropoxide, Titanium bis(ethyl acetoacetato) diisopropoxide, Titanium bis(isopropoxy) bis(ethyl acetoacetate), Titanium bis(isopropoxy)bis(ethyl acetylacetate), Titanium diacetylacetonate diisopropanolate, Titanium diisopropoxide bis(ethyl acetoacetate), Titanium diisopropoxy bis(ethyl acetoacetate), Titanium, bis(ethyl 3-oxobutanoato-<em>O</em><sup>1′</sup>,<em>O</em><sup>3</sup>)bis(2-propanolato)-, Titanium, bis(hydrogen acetoacetato)diisopropoxy-, diethyl ester, Titanium, bis[ethyl 3-(oxo-κ<em>O</em>)butanoato-κ<em>O</em>′]bis(2-propanolato)-, Tytan S 2, Tyzor 726, Tyzor DC, Tyzor PITA; object_uuid=fo-72ea33edbebf90b6 |
| 264,371 | consensus_match | cas_match_labels | — | {"27858-32-8":"exactMatch"} | group_key=bis(ethylacetoacetato‐o1',o3")bis(propan‐2‐olato)titanium||dimension=Environmental > media=Air > strata=Long-term; group_sources=['ec_inventory']; cas_sources={'27858-32-8': ['ec_inventory']}; assigned CAS labels from group consensus; object_uuid=fo-72ea33edbebf90b6: {'27858-32-8': 'exactMatch'} |
| 284,977 | rdkit_post_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C18H32O8Ti… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C18H32O8Ti… | rdkit_post_consensus from 'CCOC(=O)[CH-]C(=O)C.CCOC(=O)[CH-]C(=O)C.CC(C)[O-].CC(C)[O-].[Ti+4]'; confirmed: smiles_string, inchi2d_string, inchi2d_key_string, molecular_formula, molecular_mass, monoisotopic_mass |
| 290,781 | strip_catalogue_altlabels | altLabel | [{"@value":"2-Propanol, titanium complex","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasA… | [{"@value":"2-Propanol, titanium complex","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasA… | Removed 7 catalogue altLabel value(s): 'AKT 865' (grade code), 'CTC 754' (grade code), 'T 60' (grade code), 'T 60 (titanate)' (grade code), 'TC 710' (grade code), 'TC 750' (grade code), 'Tyzor 726' (trade name) |
| 335,345 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/633f2f82-682d-… | associations resolved on the elementary layer |
| 392,586 | normalise_property_values | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C18H32O8Ti… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C18H32O8Ti… | typed the way the ontology types it |
| 401,133 | link_flows_to_their_substance | types | — | ["https://w3id.org/chemrof/ChemicalSalt"] | 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/20260822T0600486828500000/17438 | prefLabel | ef:agent/bootstrap_labels | ef:flow/633f2f82-682d-49ab-b81f-71d20745536d/v0 | ef:flow/633f2f82-682d-49ab-b81f-71d20745536d/v1 |
| ef:activity/change/20260822T0600486828500000/17439 | name | ef:agent/bootstrap_labels | ef:flow/633f2f82-682d-49ab-b81f-71d20745536d/v1 | ef:flow/633f2f82-682d-49ab-b81f-71d20745536d/v2 |
| ef:activity/change/20260822T0600486828500000/17440 | synonyms | ef:agent/bootstrap_labels | ef:flow/633f2f82-682d-49ab-b81f-71d20745536d/v2 | ef:flow/633f2f82-682d-49ab-b81f-71d20745536d/v3 |
| ef:activity/change/20260822T0600486828500000/108694 | context | ef:agent/default_context_mapping | ef:flow/633f2f82-682d-49ab-b81f-71d20745536d/v3 | ef:flow/633f2f82-682d-49ab-b81f-71d20745536d/v4 |
| ef:activity/change/20260822T0600486828500000/108695 | context_iri | ef:agent/default_context_mapping | ef:flow/633f2f82-682d-49ab-b81f-71d20745536d/v4 | ef:flow/633f2f82-682d-49ab-b81f-71d20745536d/v5 |
| ef:activity/change/20260822T0600486828500000/219056 | unit_iri | ef:agent/unit_normalization | ef:flow/633f2f82-682d-49ab-b81f-71d20745536d/v5 | ef:flow/633f2f82-682d-49ab-b81f-71d20745536d/v6 |
| ef:activity/change/20260822T0600486828500000/225085 | prefLabel | ef:agent/normalize_name_case | ef:flow/633f2f82-682d-49ab-b81f-71d20745536d/v6 | ef:flow/633f2f82-682d-49ab-b81f-71d20745536d/v7 |
| ef:activity/change/20260822T0600486828500000/243533 | properties | ef:agent/enrich_references | ef:flow/633f2f82-682d-49ab-b81f-71d20745536d/v7 | ef:flow/633f2f82-682d-49ab-b81f-71d20745536d/v8 |
| ef:activity/change/20260822T0600486828500000/243534 | skos_definition | ef:agent/enrich_references | ef:flow/633f2f82-682d-49ab-b81f-71d20745536d/v8 | ef:flow/633f2f82-682d-49ab-b81f-71d20745536d/v9 |
| ef:activity/change/20260822T0600486828500000/243535 | references | ef:agent/enrich_references | ef:flow/633f2f82-682d-49ab-b81f-71d20745536d/v9 | ef:flow/633f2f82-682d-49ab-b81f-71d20745536d/v10 |
| ef:activity/change/20260822T0600486828500000/253030 | properties | ef:agent/rdkit_pre_consensus | ef:flow/633f2f82-682d-49ab-b81f-71d20745536d/v10 | ef:flow/633f2f82-682d-49ab-b81f-71d20745536d/v11 |
| ef:activity/change/20260822T0600486828500000/264370 | altLabel | ef:agent/consensus_match | ef:flow/633f2f82-682d-49ab-b81f-71d20745536d/v11 | ef:flow/633f2f82-682d-49ab-b81f-71d20745536d/v12 |
| ef:activity/change/20260822T0600486828500000/264371 | cas_match_labels | ef:agent/consensus_match | ef:flow/633f2f82-682d-49ab-b81f-71d20745536d/v12 | ef:flow/633f2f82-682d-49ab-b81f-71d20745536d/v13 |
| ef:activity/change/20260822T0600486828500000/284977 | properties | ef:agent/rdkit_post_consensus | ef:flow/633f2f82-682d-49ab-b81f-71d20745536d/v13 | ef:flow/633f2f82-682d-49ab-b81f-71d20745536d/v14 |
| ef:activity/change/20260822T0600486828500000/290781 | altLabel | ef:agent/strip_catalogue_altlabels | ef:flow/633f2f82-682d-49ab-b81f-71d20745536d/v14 | ef:flow/633f2f82-682d-49ab-b81f-71d20745536d/v15 |
| ef:activity/change/20260822T0600486828500000/335345 | concept_associations | ef:agent/carry_associations_onto_flows | ef:flow/633f2f82-682d-49ab-b81f-71d20745536d/v15 | ef:flow/633f2f82-682d-49ab-b81f-71d20745536d/v16 |
| ef:activity/change/20260822T0600486828500000/392586 | properties | ef:agent/normalise_property_values | ef:flow/633f2f82-682d-49ab-b81f-71d20745536d/v16 | ef:flow/633f2f82-682d-49ab-b81f-71d20745536d/v17 |
| ef:activity/change/20260822T0600486828500000/401133 | types | ef:agent/link_flows_to_their_substance | ef:flow/633f2f82-682d-49ab-b81f-71d20745536d/v17 | ef:flow/633f2f82-682d-49ab-b81f-71d20745536d/v18 |