Benzal Chloride
Everything that changed this flow. Back to the flow
9f208021-691d-4a79-b549-9c91410332ae
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 | 2 | consensus_match, strip_catalogue_altlabels | Removed 1 catalogue altLabel value(s): 'NSC 7915' (registry 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=benzalchloride||dimension=Environmental > media=Air > strata=Medium stack, <150 meters > population_density=Rural (<1000 people/square mile); group_sources=['chebi', 'ec_inventory', 'pubchem']; cas_sources={'98-87-3': ['chebi', 'ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-1923bc5b65aadc56: {'98-87-3': '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 |
| 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 |
| ec_numbers | 1 | ec_cross_check | Resolved from EC-inventory: 202-709-2 from CAS 98-87-3 |
| name | 1 | bootstrap_labels | Purged legacy name field to enforce prefLabel usage |
| references | 1 | enrich_references | Added references with provenance; cas_numbers=['98-87-3']; matched_chebi_ids=['http://purl.obolibrary.org/obo/CHEBI_82273']; candidate_pubchem_cids=[7411, 735854]; selected_pubchem_cids=[7411]; 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 |
| 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
19| # | Step | Field | From | To | Why |
|---|---|---|---|---|---|
| 13,269 | bootstrap_labels | prefLabel | — | [{"@value":"Benzal chloride","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:wasAttributedTo"… | Bootstrapped prefLabel from legacy name field |
| 13,270 | bootstrap_labels | name | Benzal chloride | — | Purged legacy name field to enforce prefLabel usage |
| 144,372 | default_context_mapping | context | — | {"dimension":"Environmental","media":"Water","water_body":"Unknown"} | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to water > Emissions to water, unspecified |
| 144,373 | default_context_mapping | context_iri | — | https://vocab.brightway.one/flow-contexts/envi-wate-unkn | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to water > Emissions to water, unspecified |
| 217,725 | unit_normalization | unit_iri | — | https://vocab.brightway.one/units/unit/KiloGM | Unit IRI set from normalization of 'kg' |
| 224,169 | normalize_name_case | prefLabel | [{"@value":"Benzal chloride","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:wasAttributedTo"… | [{"@value":"Benzal Chloride","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:wasAttributedTo"… | Title-cased words without internal capitals (preserved words with uppercase letters beyond the first character) |
| 226,961 | ec_cross_check | ec_numbers | [] | ["202-709-2"] | Resolved from EC-inventory: 202-709-2 from CAS 98-87-3 |
| 239,761 | enrich_references | properties | {} | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C7H6Cl2"],… | Added ChEBI/PubChem properties (chebi_ids=1, pubchem_cids=1) |
| 239,762 | enrich_references | skos_definition | — | [] | Merged ChEBI/PubChem definitions into skos:definition |
| 239,763 | enrich_references | references | [] | [{"@id":"http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J3.986A","provenance":{"prov:wasGeneratedBy":"enrich_reference… | Added references with provenance; cas_numbers=['98-87-3']; matched_chebi_ids=['http://purl.obolibrary.org/obo/CHEBI_82273']; candidate_pubchem_cids=[7411, 735854]; selected_pubchem_cids=[7411]; 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 |
| 251,933 | rdkit_pre_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C7H6Cl2"],… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C7H6Cl2"],… | rdkit_pre_consensus from 'C1=CC=C(C=C1)C(Cl)Cl'; added: monoisotopic_mass |
| 264,063 | consensus_match | altLabel | [] | [{"@value":"(Dichloromethyl)benzene","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttrib… | group_key=benzalchloride||dimension=Environmental > media=Air > strata=Medium stack, <150 meters > population_density=Rural (<1000 people/square mile); cas=98-87-3; added Common Chemistry CAS names as altLabel: (Dichloromethyl)benzene, Benzene, (dichloromethyl)-, Benzyl dichloride, Benzylene chloride, Benzylidene chloride, Dichlorophenylmethane, NSC 7915, Toluene, α,α-dichloro-, α,α-Dichlorotoluene; object_uuid=fo-1923bc5b65aadc56 |
| 264,064 | consensus_match | cas_match_labels | — | {"98-87-3":"exactMatch"} | group_key=benzalchloride||dimension=Environmental > media=Air > strata=Medium stack, <150 meters > population_density=Rural (<1000 people/square mile); group_sources=['chebi', 'ec_inventory', 'pubchem']; cas_sources={'98-87-3': ['chebi', 'ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-1923bc5b65aadc56: {'98-87-3': 'exactMatch'} |
| 277,129 | opsin_iupac | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C7H6Cl2"],… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C7H6Cl2"],… | opsin_iupac: set authoritative IUPAC name, SMILES, InChI from 'Benzal Chloride' |
| 283,789 | rdkit_post_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C7H6Cl2"],… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C7H6Cl2"],… | rdkit_post_consensus from 'ClC(Cl)c1ccccc1'; confirmed: smiles_string, inchi2d_string, inchi2d_key_string, molecular_formula, molecular_mass, monoisotopic_mass |
| 289,983 | strip_catalogue_altlabels | altLabel | [{"@value":"(Dichloromethyl)benzene","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttrib… | [{"@value":"(Dichloromethyl)benzene","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttrib… | Removed 1 catalogue altLabel value(s): 'NSC 7915' (registry code) |
| 353,188 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/9f208021-691d-… | associations resolved on the elementary layer |
| 391,478 | normalise_property_values | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C7H6Cl2"],… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C7H6Cl2"],… | typed the way the ontology types it |
| 399,530 | link_flows_to_their_substance | types | — | ["https://w3id.org/chemrof/NeutralMolecule"] | the substance's answer, copied onto its flow |
PROV-O trail
19 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/20260821T1554374006150000/13269 | prefLabel | ef:agent/bootstrap_labels | ef:flow/9f208021-691d-4a79-b549-9c91410332ae/v0 | ef:flow/9f208021-691d-4a79-b549-9c91410332ae/v1 |
| ef:activity/change/20260821T1554374006150000/13270 | name | ef:agent/bootstrap_labels | ef:flow/9f208021-691d-4a79-b549-9c91410332ae/v1 | ef:flow/9f208021-691d-4a79-b549-9c91410332ae/v2 |
| ef:activity/change/20260821T1554374006150000/144372 | context | ef:agent/default_context_mapping | ef:flow/9f208021-691d-4a79-b549-9c91410332ae/v2 | ef:flow/9f208021-691d-4a79-b549-9c91410332ae/v3 |
| ef:activity/change/20260821T1554374006150000/144373 | context_iri | ef:agent/default_context_mapping | ef:flow/9f208021-691d-4a79-b549-9c91410332ae/v3 | ef:flow/9f208021-691d-4a79-b549-9c91410332ae/v4 |
| ef:activity/change/20260821T1554374006150000/217725 | unit_iri | ef:agent/unit_normalization | ef:flow/9f208021-691d-4a79-b549-9c91410332ae/v4 | ef:flow/9f208021-691d-4a79-b549-9c91410332ae/v5 |
| ef:activity/change/20260821T1554374006150000/224169 | prefLabel | ef:agent/normalize_name_case | ef:flow/9f208021-691d-4a79-b549-9c91410332ae/v5 | ef:flow/9f208021-691d-4a79-b549-9c91410332ae/v6 |
| ef:activity/change/20260821T1554374006150000/226961 | ec_numbers | ef:agent/ec_cross_check | ef:flow/9f208021-691d-4a79-b549-9c91410332ae/v6 | ef:flow/9f208021-691d-4a79-b549-9c91410332ae/v7 |
| ef:activity/change/20260821T1554374006150000/239761 | properties | ef:agent/enrich_references | ef:flow/9f208021-691d-4a79-b549-9c91410332ae/v7 | ef:flow/9f208021-691d-4a79-b549-9c91410332ae/v8 |
| ef:activity/change/20260821T1554374006150000/239762 | skos_definition | ef:agent/enrich_references | ef:flow/9f208021-691d-4a79-b549-9c91410332ae/v8 | ef:flow/9f208021-691d-4a79-b549-9c91410332ae/v9 |
| ef:activity/change/20260821T1554374006150000/239763 | references | ef:agent/enrich_references | ef:flow/9f208021-691d-4a79-b549-9c91410332ae/v9 | ef:flow/9f208021-691d-4a79-b549-9c91410332ae/v10 |
| ef:activity/change/20260821T1554374006150000/251933 | properties | ef:agent/rdkit_pre_consensus | ef:flow/9f208021-691d-4a79-b549-9c91410332ae/v10 | ef:flow/9f208021-691d-4a79-b549-9c91410332ae/v11 |
| ef:activity/change/20260821T1554374006150000/264063 | altLabel | ef:agent/consensus_match | ef:flow/9f208021-691d-4a79-b549-9c91410332ae/v11 | ef:flow/9f208021-691d-4a79-b549-9c91410332ae/v12 |
| ef:activity/change/20260821T1554374006150000/264064 | cas_match_labels | ef:agent/consensus_match | ef:flow/9f208021-691d-4a79-b549-9c91410332ae/v12 | ef:flow/9f208021-691d-4a79-b549-9c91410332ae/v13 |
| ef:activity/change/20260821T1554374006150000/277129 | properties | ef:agent/opsin_iupac | ef:flow/9f208021-691d-4a79-b549-9c91410332ae/v13 | ef:flow/9f208021-691d-4a79-b549-9c91410332ae/v14 |
| ef:activity/change/20260821T1554374006150000/283789 | properties | ef:agent/rdkit_post_consensus | ef:flow/9f208021-691d-4a79-b549-9c91410332ae/v14 | ef:flow/9f208021-691d-4a79-b549-9c91410332ae/v15 |
| ef:activity/change/20260821T1554374006150000/289983 | altLabel | ef:agent/strip_catalogue_altlabels | ef:flow/9f208021-691d-4a79-b549-9c91410332ae/v15 | ef:flow/9f208021-691d-4a79-b549-9c91410332ae/v16 |
| ef:activity/change/20260821T1554374006150000/353188 | concept_associations | ef:agent/carry_associations_onto_flows | ef:flow/9f208021-691d-4a79-b549-9c91410332ae/v16 | ef:flow/9f208021-691d-4a79-b549-9c91410332ae/v17 |
| ef:activity/change/20260821T1554374006150000/391478 | properties | ef:agent/normalise_property_values | ef:flow/9f208021-691d-4a79-b549-9c91410332ae/v17 | ef:flow/9f208021-691d-4a79-b549-9c91410332ae/v18 |
| ef:activity/change/20260821T1554374006150000/399530 | types | ef:agent/link_flows_to_their_substance | ef:flow/9f208021-691d-4a79-b549-9c91410332ae/v18 | ef:flow/9f208021-691d-4a79-b549-9c91410332ae/v19 |