Titanium Tetraisopropanolate
Everything that changed this flow. Back to the flow
d0524915-342e-4d13-943a-3d3a4d6897b3
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 | 3 | chebi_altlabels, consensus_match, strip_catalogue_altlabels | Removed 7 catalogue altLabel value(s): 'A 1' (grade code), 'A 1 (titanate)' (grade code), 'AKT 872' (grade code), 'HY 1802' (grade code), 'NDH 510C' (grade code), 'TA 10' (grade code), 'TPTA 1' (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=titaniumtetraisopropanolate||dimension=Environmental > media=Air > strata=Medium stack, <150 meters > population_density=Rural (<1000 people/square mile); group_sources=['chebi', 'ec_inventory', 'pubchem']; cas_sources={'546-68-9': ['chebi', 'ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-9c6a528bf561a579: {'546-68-9': '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 soil > Emissions to agricultural soil |
| context_iri | 1 | default_context_mapping | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to soil > Emissions to agricultural soil |
| name | 1 | bootstrap_labels | Purged legacy name field to enforce prefLabel usage |
| references | 1 | enrich_references | Added references with provenance; cas_numbers=['546-68-9']; matched_chebi_ids=['http://purl.obolibrary.org/obo/CHEBI_139496']; candidate_pubchem_cids=[4891, 7220, 11026, 110612, 224005, 25199637, 25200171, 87058095]; selected_pubchem_cids=[11026]; 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 |
|---|---|---|---|---|---|
| 4,086 | bootstrap_labels | prefLabel | — | [{"@value":"titanium tetraisopropanolate","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:was… | Bootstrapped prefLabel from legacy name field |
| 4,087 | bootstrap_labels | name | titanium tetraisopropanolate | — | Purged legacy name field to enforce prefLabel usage |
| 4,088 | bootstrap_labels | synonyms | ["organometallic","titaniumtetraisopropanolate","insocat138","tytantipt","tyzortpt","tyzorâ®tpt","vertecac213","verteca… | [] | Removed legacy synonyms field in favor of structured labels |
| 173,214 | default_context_mapping | context | — | {"dimension":"Environmental","media":"Ground","geography":"Agricultural"} | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to soil > Emissions to agricultural soil |
| 173,215 | default_context_mapping | context_iri | — | https://vocab.brightway.one/flow-contexts/envi-grou-agri | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to soil > Emissions to agricultural soil |
| 214,705 | unit_normalization | unit_iri | — | https://vocab.brightway.one/units/unit/KiloGM | Unit IRI set from normalization of 'kg' |
| 222,032 | normalize_name_case | prefLabel | [{"@value":"titanium tetraisopropanolate","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:was… | [{"@value":"Titanium Tetraisopropanolate","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:was… | Title-cased words without internal capitals (preserved words with uppercase letters beyond the first character) |
| 231,114 | enrich_references | properties | {} | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["4C3H7O.Ti"… | Added ChEBI/PubChem properties (chebi_ids=1, pubchem_cids=1) |
| 231,115 | enrich_references | skos_definition | — | [{"@value":"A titanium coordination entity consisting of a titanium(IV) cation with four propan-2-olate anions as count… | Merged ChEBI/PubChem definitions into skos:definition |
| 231,116 | enrich_references | references | [] | [{"@id":"https://chem.echa.europa.eu/100.008.100","provenance":{"prov:wasGeneratedBy":"enrich_references.pubchem_identi… | Added references with provenance; cas_numbers=['546-68-9']; matched_chebi_ids=['http://purl.obolibrary.org/obo/CHEBI_139496']; candidate_pubchem_cids=[4891, 7220, 11026, 110612, 224005, 25199637, 25200171, 87058095]; selected_pubchem_cids=[11026]; 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 |
| 249,450 | rdkit_pre_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["4C3H7O.Ti"… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["4C3H7O.Ti"… | rdkit_pre_consensus from 'CC(C)[O-].CC(C)[O-].CC(C)[O-].CC(C)[O-].[Ti+4]'; added: monoisotopic_mass |
| 254,902 | chebi_altlabels | altLabel | [] | [{"@value":"2-propanol, titanium(4+) salt (4:1)","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","pr… | Added 10 ChEBI synonym(s) as altLabel from 1 linked ChEBI record(s) |
| 272,662 | consensus_match | altLabel | [{"@value":"2-propanol, titanium(4+) salt (4:1)","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","pr… | [{"@value":"2-propanol, titanium(4+) salt (4:1)","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","pr… | group_key=titaniumtetraisopropanolate||dimension=Environmental > media=Air > strata=Medium stack, <150 meters > population_density=Rural (<1000 people/square mile); cas=546-68-9; added Common Chemistry CAS names as altLabel: 2-Propanol, titanium salt (4:1), 2-Propanol, titanium(4+) salt, 5N, 5N (titanate), A 1, A 1 (titanate), AKT 872, Bistrater H-NDH 510C, HY 1802, Isopropyl alcohol, titanium(4+) salt, Isopropyl orthotitanate, Isopropyl titanate(IV) ((C<sub>3</sub>H<sub>7</sub>O)<sub>4</sub>Ti), JTW-TPT, NDH 510C, Orgatix TA 10, Orgatix TA 8, TA 10, TIPT, TPT, TPTA 1, Tetraisopropoxytitanium, Tetraisopropoxytitanium(IV), Tetrakis(isopropanolato)titanium, Tetrakis(isopropoxide)titanium, Tetrakis(isopropylato)titanium(IV), Tetrakis(isopropyloxy)titanium, Tilcom TIPT, Titanium isopropoxide (Ti(OC<sub>3</sub>H<sub>7</sub>)<sub>4</sub>), Titanium tetraisopropoxide, Titanium tetrakis(<em>iso</em>-propoxide), Titanium tetrakis(isopropoxide), Titanium(4+) isopropoxide, Titanium(IV) isopropoxide, Titanium(IV) isoproproxide, Titanium, tetrakis(1-methylethoxy)-, Tytan Tipt, Tyzor TPT, Vertec RJCE, Vertec TIPT, Vertec XI 900, Vertec XL 110; object_uuid=fo-9c6a528bf561a579 |
| 272,663 | consensus_match | cas_match_labels | — | {"546-68-9":"exactMatch"} | group_key=titaniumtetraisopropanolate||dimension=Environmental > media=Air > strata=Medium stack, <150 meters > population_density=Rural (<1000 people/square mile); group_sources=['chebi', 'ec_inventory', 'pubchem']; cas_sources={'546-68-9': ['chebi', 'ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-9c6a528bf561a579: {'546-68-9': 'exactMatch'} |
| 274,582 | opsin_iupac | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["4C3H7O.Ti"… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["4C3H7O.Ti"… | opsin_iupac: set authoritative IUPAC name, SMILES, InChI from 'Titanium Tetraisopropanolate' |
| 281,033 | rdkit_post_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["4C3H7O.Ti"… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["4C3H7O.Ti"… | rdkit_post_consensus from 'CC(C)[O-].CC(C)[O-].CC(C)[O-].CC(C)[O-].[Ti+4]'; confirmed: smiles_string, inchi2d_string, inchi2d_key_string, molecular_formula, molecular_mass, monoisotopic_mass |
| 288,090 | strip_catalogue_altlabels | altLabel | [{"@value":"2-propanol, titanium(4+) salt (4:1)","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","pr… | [{"@value":"2-propanol, titanium(4+) salt (4:1)","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","pr… | Removed 7 catalogue altLabel value(s): 'A 1' (grade code), 'A 1 (titanate)' (grade code), 'AKT 872' (grade code), 'HY 1802' (grade code), 'NDH 510C' (grade code), 'TA 10' (grade code), 'TPTA 1' (grade code) |
| 367,631 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/d0524915-342e-… | associations resolved on the elementary layer |
| 388,889 | normalise_property_values | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["4C3H7O.Ti"… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["4C3H7O.Ti"… | typed the way the ontology types it |
| 395,812 | link_flows_to_their_substance | types | — | ["https://w3id.org/chemrof/ChemicalSalt"] | 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/20260821T1554374006150000/4086 | prefLabel | ef:agent/bootstrap_labels | ef:flow/d0524915-342e-4d13-943a-3d3a4d6897b3/v0 | ef:flow/d0524915-342e-4d13-943a-3d3a4d6897b3/v1 |
| ef:activity/change/20260821T1554374006150000/4087 | name | ef:agent/bootstrap_labels | ef:flow/d0524915-342e-4d13-943a-3d3a4d6897b3/v1 | ef:flow/d0524915-342e-4d13-943a-3d3a4d6897b3/v2 |
| ef:activity/change/20260821T1554374006150000/4088 | synonyms | ef:agent/bootstrap_labels | ef:flow/d0524915-342e-4d13-943a-3d3a4d6897b3/v2 | ef:flow/d0524915-342e-4d13-943a-3d3a4d6897b3/v3 |
| ef:activity/change/20260821T1554374006150000/173214 | context | ef:agent/default_context_mapping | ef:flow/d0524915-342e-4d13-943a-3d3a4d6897b3/v3 | ef:flow/d0524915-342e-4d13-943a-3d3a4d6897b3/v4 |
| ef:activity/change/20260821T1554374006150000/173215 | context_iri | ef:agent/default_context_mapping | ef:flow/d0524915-342e-4d13-943a-3d3a4d6897b3/v4 | ef:flow/d0524915-342e-4d13-943a-3d3a4d6897b3/v5 |
| ef:activity/change/20260821T1554374006150000/214705 | unit_iri | ef:agent/unit_normalization | ef:flow/d0524915-342e-4d13-943a-3d3a4d6897b3/v5 | ef:flow/d0524915-342e-4d13-943a-3d3a4d6897b3/v6 |
| ef:activity/change/20260821T1554374006150000/222032 | prefLabel | ef:agent/normalize_name_case | ef:flow/d0524915-342e-4d13-943a-3d3a4d6897b3/v6 | ef:flow/d0524915-342e-4d13-943a-3d3a4d6897b3/v7 |
| ef:activity/change/20260821T1554374006150000/231114 | properties | ef:agent/enrich_references | ef:flow/d0524915-342e-4d13-943a-3d3a4d6897b3/v7 | ef:flow/d0524915-342e-4d13-943a-3d3a4d6897b3/v8 |
| ef:activity/change/20260821T1554374006150000/231115 | skos_definition | ef:agent/enrich_references | ef:flow/d0524915-342e-4d13-943a-3d3a4d6897b3/v8 | ef:flow/d0524915-342e-4d13-943a-3d3a4d6897b3/v9 |
| ef:activity/change/20260821T1554374006150000/231116 | references | ef:agent/enrich_references | ef:flow/d0524915-342e-4d13-943a-3d3a4d6897b3/v9 | ef:flow/d0524915-342e-4d13-943a-3d3a4d6897b3/v10 |
| ef:activity/change/20260821T1554374006150000/249450 | properties | ef:agent/rdkit_pre_consensus | ef:flow/d0524915-342e-4d13-943a-3d3a4d6897b3/v10 | ef:flow/d0524915-342e-4d13-943a-3d3a4d6897b3/v11 |
| ef:activity/change/20260821T1554374006150000/254902 | altLabel | ef:agent/chebi_altlabels | ef:flow/d0524915-342e-4d13-943a-3d3a4d6897b3/v11 | ef:flow/d0524915-342e-4d13-943a-3d3a4d6897b3/v12 |
| ef:activity/change/20260821T1554374006150000/272662 | altLabel | ef:agent/consensus_match | ef:flow/d0524915-342e-4d13-943a-3d3a4d6897b3/v12 | ef:flow/d0524915-342e-4d13-943a-3d3a4d6897b3/v13 |
| ef:activity/change/20260821T1554374006150000/272663 | cas_match_labels | ef:agent/consensus_match | ef:flow/d0524915-342e-4d13-943a-3d3a4d6897b3/v13 | ef:flow/d0524915-342e-4d13-943a-3d3a4d6897b3/v14 |
| ef:activity/change/20260821T1554374006150000/274582 | properties | ef:agent/opsin_iupac | ef:flow/d0524915-342e-4d13-943a-3d3a4d6897b3/v14 | ef:flow/d0524915-342e-4d13-943a-3d3a4d6897b3/v15 |
| ef:activity/change/20260821T1554374006150000/281033 | properties | ef:agent/rdkit_post_consensus | ef:flow/d0524915-342e-4d13-943a-3d3a4d6897b3/v15 | ef:flow/d0524915-342e-4d13-943a-3d3a4d6897b3/v16 |
| ef:activity/change/20260821T1554374006150000/288090 | altLabel | ef:agent/strip_catalogue_altlabels | ef:flow/d0524915-342e-4d13-943a-3d3a4d6897b3/v16 | ef:flow/d0524915-342e-4d13-943a-3d3a4d6897b3/v17 |
| ef:activity/change/20260821T1554374006150000/367631 | concept_associations | ef:agent/carry_associations_onto_flows | ef:flow/d0524915-342e-4d13-943a-3d3a4d6897b3/v17 | ef:flow/d0524915-342e-4d13-943a-3d3a4d6897b3/v18 |
| ef:activity/change/20260821T1554374006150000/388889 | properties | ef:agent/normalise_property_values | ef:flow/d0524915-342e-4d13-943a-3d3a4d6897b3/v18 | ef:flow/d0524915-342e-4d13-943a-3d3a4d6897b3/v19 |
| ef:activity/change/20260821T1554374006150000/395812 | types | ef:agent/link_flows_to_their_substance | ef:flow/d0524915-342e-4d13-943a-3d3a4d6897b3/v19 | ef:flow/d0524915-342e-4d13-943a-3d3a4d6897b3/v20 |