Oxotitanium Dihydrochloride
Everything that changed this flow. Back to the flow
8f5272f0-4497-4017-9917-47145bb59781
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, dedupe_altlabels | Deduplicated altLabel values and removed entries matching prefLabel |
| 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=oxotitaniumdihydrochloride||dimension=Environmental > media=Air > strata=Medium stack, <150 meters > population_density=Rural (<1000 people/square mile); group_sources=['ec_inventory']; cas_sources={'13780-39-7': ['ec_inventory']}; assigned CAS labels from group consensus; object_uuid=fo-f1ff5fa411c7a059: {'13780-39-7': '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=['13780-39-7']; matched_chebi_ids=[]; candidate_pubchem_cids=[83729, 257453, 101282771]; selected_pubchem_cids=[83729]; 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 |
|---|---|---|---|---|---|
| 19,941 | bootstrap_labels | prefLabel | — | [{"@value":"oxotitanium dihydrochloride","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:wasA… | Bootstrapped prefLabel from legacy name field |
| 19,942 | bootstrap_labels | name | oxotitanium dihydrochloride | — | Purged legacy name field to enforce prefLabel usage |
| 19,943 | bootstrap_labels | synonyms | ["inorganic","dichloridetitaniumoxide","kronos6020","kronosoxychloride","titanoxychloride","tradedastitaniumoxychloride… | [] | Removed legacy synonyms field in favor of structured labels |
| 134,984 | 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) |
| 134,985 | 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) |
| 219,816 | unit_normalization | unit_iri | — | https://vocab.brightway.one/units/unit/KiloGM | Unit IRI set from normalization of 'kg' |
| 225,621 | normalize_name_case | prefLabel | [{"@value":"oxotitanium dihydrochloride","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:wasA… | [{"@value":"Oxotitanium Dihydrochloride","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:wasA… | Title-cased words without internal capitals (preserved words with uppercase letters beyond the first character) |
| 245,669 | enrich_references | properties | {} | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["Cl2H2OTi"]… | Added ChEBI/PubChem properties (chebi_ids=0, pubchem_cids=1) |
| 245,670 | enrich_references | skos_definition | — | [] | Merged ChEBI/PubChem definitions into skos:definition |
| 245,671 | enrich_references | references | [] | [{"@id":"https://chem.echa.europa.eu/100.034.013","provenance":{"prov:wasGeneratedBy":"enrich_references.pubchem_identi… | Added references with provenance; cas_numbers=['13780-39-7']; matched_chebi_ids=[]; candidate_pubchem_cids=[83729, 257453, 101282771]; selected_pubchem_cids=[83729]; 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 |
| 253,646 | rdkit_pre_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["Cl2H2OTi"]… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["Cl2H2OTi",… | rdkit_pre_consensus from 'O=[Ti].Cl.Cl'; added: molecular_formula, molecular_mass, monoisotopic_mass |
| 270,244 | consensus_match | altLabel | [] | [{"@value":"Dichlorooxotitanium","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributed… | group_key=oxotitaniumdihydrochloride||dimension=Environmental > media=Air > strata=Medium stack, <150 meters > population_density=Rural (<1000 people/square mile); cas=13780-39-7; added Common Chemistry CAS names as altLabel: Dichlorooxotitanium, Titanium chloride oxide, Titanium chloride oxide (TiCl<sub>2</sub>O), Titanium chloride oxide (TiOCl<sub>2</sub>), Titanium dichloride oxide, Titanium dichloride oxide (TiCl<sub>2</sub>O), Titanium oxy dichloride, Titanium oxychloride, Titanium, dichlorooxo-, Titanyl chloride, Titanyl chloride (TiOCl<sub>2</sub>), Titanyl dichloride; object_uuid=fo-f1ff5fa411c7a059 |
| 270,245 | consensus_match | cas_match_labels | — | {"13780-39-7":"exactMatch"} | group_key=oxotitaniumdihydrochloride||dimension=Environmental > media=Air > strata=Medium stack, <150 meters > population_density=Rural (<1000 people/square mile); group_sources=['ec_inventory']; cas_sources={'13780-39-7': ['ec_inventory']}; assigned CAS labels from group consensus; object_uuid=fo-f1ff5fa411c7a059: {'13780-39-7': 'exactMatch'} |
| 285,663 | rdkit_post_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["Cl2H2OTi",… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["Cl2H2OTi",… | rdkit_post_consensus from 'O=[Ti].Cl.Cl'; confirmed: smiles_string, inchi2d_string, inchi2d_key_string, molecular_formula, molecular_mass, monoisotopic_mass |
| 293,062 | dedupe_altlabels | altLabel | [{"@value":"Dichlorooxotitanium","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributed… | [{"@value":"Dichlorooxotitanium","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributed… | Deduplicated altLabel values and removed entries matching prefLabel |
| 348,488 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/8f5272f0-4497-… | associations resolved on the elementary layer |
| 393,235 | normalise_property_values | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["Cl2H2OTi",… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["Cl2H2OTi",… | typed the way the ontology types it |
| 402,099 | link_flows_to_their_substance | types | — | ["https://w3id.org/chemrof/MolecularComplex"] | 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/20260822T0600486828500000/19941 | prefLabel | ef:agent/bootstrap_labels | ef:flow/8f5272f0-4497-4017-9917-47145bb59781/v0 | ef:flow/8f5272f0-4497-4017-9917-47145bb59781/v1 |
| ef:activity/change/20260822T0600486828500000/19942 | name | ef:agent/bootstrap_labels | ef:flow/8f5272f0-4497-4017-9917-47145bb59781/v1 | ef:flow/8f5272f0-4497-4017-9917-47145bb59781/v2 |
| ef:activity/change/20260822T0600486828500000/19943 | synonyms | ef:agent/bootstrap_labels | ef:flow/8f5272f0-4497-4017-9917-47145bb59781/v2 | ef:flow/8f5272f0-4497-4017-9917-47145bb59781/v3 |
| ef:activity/change/20260822T0600486828500000/134984 | context | ef:agent/default_context_mapping | ef:flow/8f5272f0-4497-4017-9917-47145bb59781/v3 | ef:flow/8f5272f0-4497-4017-9917-47145bb59781/v4 |
| ef:activity/change/20260822T0600486828500000/134985 | context_iri | ef:agent/default_context_mapping | ef:flow/8f5272f0-4497-4017-9917-47145bb59781/v4 | ef:flow/8f5272f0-4497-4017-9917-47145bb59781/v5 |
| ef:activity/change/20260822T0600486828500000/219816 | unit_iri | ef:agent/unit_normalization | ef:flow/8f5272f0-4497-4017-9917-47145bb59781/v5 | ef:flow/8f5272f0-4497-4017-9917-47145bb59781/v6 |
| ef:activity/change/20260822T0600486828500000/225621 | prefLabel | ef:agent/normalize_name_case | ef:flow/8f5272f0-4497-4017-9917-47145bb59781/v6 | ef:flow/8f5272f0-4497-4017-9917-47145bb59781/v7 |
| ef:activity/change/20260822T0600486828500000/245669 | properties | ef:agent/enrich_references | ef:flow/8f5272f0-4497-4017-9917-47145bb59781/v7 | ef:flow/8f5272f0-4497-4017-9917-47145bb59781/v8 |
| ef:activity/change/20260822T0600486828500000/245670 | skos_definition | ef:agent/enrich_references | ef:flow/8f5272f0-4497-4017-9917-47145bb59781/v8 | ef:flow/8f5272f0-4497-4017-9917-47145bb59781/v9 |
| ef:activity/change/20260822T0600486828500000/245671 | references | ef:agent/enrich_references | ef:flow/8f5272f0-4497-4017-9917-47145bb59781/v9 | ef:flow/8f5272f0-4497-4017-9917-47145bb59781/v10 |
| ef:activity/change/20260822T0600486828500000/253646 | properties | ef:agent/rdkit_pre_consensus | ef:flow/8f5272f0-4497-4017-9917-47145bb59781/v10 | ef:flow/8f5272f0-4497-4017-9917-47145bb59781/v11 |
| ef:activity/change/20260822T0600486828500000/270244 | altLabel | ef:agent/consensus_match | ef:flow/8f5272f0-4497-4017-9917-47145bb59781/v11 | ef:flow/8f5272f0-4497-4017-9917-47145bb59781/v12 |
| ef:activity/change/20260822T0600486828500000/270245 | cas_match_labels | ef:agent/consensus_match | ef:flow/8f5272f0-4497-4017-9917-47145bb59781/v12 | ef:flow/8f5272f0-4497-4017-9917-47145bb59781/v13 |
| ef:activity/change/20260822T0600486828500000/285663 | properties | ef:agent/rdkit_post_consensus | ef:flow/8f5272f0-4497-4017-9917-47145bb59781/v13 | ef:flow/8f5272f0-4497-4017-9917-47145bb59781/v14 |
| ef:activity/change/20260822T0600486828500000/293062 | altLabel | ef:agent/dedupe_altlabels | ef:flow/8f5272f0-4497-4017-9917-47145bb59781/v14 | ef:flow/8f5272f0-4497-4017-9917-47145bb59781/v15 |
| ef:activity/change/20260822T0600486828500000/348488 | concept_associations | ef:agent/carry_associations_onto_flows | ef:flow/8f5272f0-4497-4017-9917-47145bb59781/v15 | ef:flow/8f5272f0-4497-4017-9917-47145bb59781/v16 |
| ef:activity/change/20260822T0600486828500000/393235 | properties | ef:agent/normalise_property_values | ef:flow/8f5272f0-4497-4017-9917-47145bb59781/v16 | ef:flow/8f5272f0-4497-4017-9917-47145bb59781/v17 |
| ef:activity/change/20260822T0600486828500000/402099 | types | ef:agent/link_flows_to_their_substance | ef:flow/8f5272f0-4497-4017-9917-47145bb59781/v17 | ef:flow/8f5272f0-4497-4017-9917-47145bb59781/v18 |