4,4'-methylenebis(2,6-dimethylphenol)
Everything that changed this flow. Back to the flow
145e986a-73f4-40f9-a7c3-110c97448e0a
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 128403' (registry code) |
| cas_match_labels | 1 | consensus_match | group_key=4,4'-methylenebis(2,6-dimethylphenol)||dimension=Environmental > media=Air > strata=Medium stack, <150 meters > population_density=Rural (<1000 people/square mile); group_sources=['ec_inventory', 'pubchem']; cas_sources={'5384-21-4': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-d4ce7c638f1a6e68: {'5384-21-4': '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 air > Emissions to non-urban air or from high stacks |
| context_iri | 1 | default_context_mapping | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to air > Emissions to non-urban air or from high stacks |
| name | 1 | bootstrap_labels | Purged legacy name field to enforce prefLabel usage |
| prefLabel | 1 | bootstrap_labels | Bootstrapped prefLabel from legacy name field |
| references | 1 | enrich_references | Added references with provenance; cas_numbers=['5384-21-4']; matched_chebi_ids=[]; candidate_pubchem_cids=[79345, 218872]; selected_pubchem_cids=[79345]; 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 |
|---|---|---|---|---|---|
| 14,505 | bootstrap_labels | prefLabel | — | [{"@value":"4,4'-methylenebis(2,6-dimethylphenol)","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels",… | Bootstrapped prefLabel from legacy name field |
| 14,506 | bootstrap_labels | name | 4,4'-methylenebis(2,6-dimethylphenol) | — | Purged legacy name field to enforce prefLabel usage |
| 14,507 | bootstrap_labels | synonyms | ["organic","4,4'","-methylenedi-2,6-xylenol"] | [] | Removed legacy synonyms field in favor of structured labels |
| 49,422 | default_context_mapping | context | — | {"dimension":"Environmental","media":"Air","strata":"Medium stack, <150 meters","population_density":"Rural (<1000 peop… | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to air > Emissions to non-urban air or from high stacks |
| 49,423 | default_context_mapping | context_iri | — | https://vocab.brightway.one/flow-contexts/envi-air-mest15me-ru10pesq | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to air > Emissions to non-urban air or from high stacks |
| 218,127 | unit_normalization | unit_iri | — | https://vocab.brightway.one/units/unit/KiloGM | Unit IRI set from normalization of 'kg' |
| 240,915 | enrich_references | properties | {} | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C17H20O2"]… | Added ChEBI/PubChem properties (chebi_ids=0, pubchem_cids=1) |
| 240,916 | enrich_references | skos_definition | — | [] | Merged ChEBI/PubChem definitions into skos:definition |
| 240,917 | enrich_references | references | [] | [{"@id":"http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J103.329H","provenance":{"prov:wasGeneratedBy":"enrich_referen… | Added references with provenance; cas_numbers=['5384-21-4']; matched_chebi_ids=[]; candidate_pubchem_cids=[79345, 218872]; selected_pubchem_cids=[79345]; 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 |
| 252,273 | rdkit_pre_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C17H20O2"]… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C17H20O2"]… | rdkit_pre_consensus from 'CC1=CC(=CC(=C1O)C)CC2=CC(=C(C(=C2)C)O)C'; added: molecular_mass, monoisotopic_mass |
| 262,336 | consensus_match | altLabel | [] | [{"@value":"2,6-Xylenol, 4,4′-methylenedi-","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wa… | group_key=4,4'-methylenebis(2,6-dimethylphenol)||dimension=Environmental > media=Air > strata=Medium stack, <150 meters > population_density=Rural (<1000 people/square mile); cas=5384-21-4; added Common Chemistry CAS names as altLabel: 2,6-Xylenol, 4,4′-methylenedi-, 3,3′,5,5′-Tetramethyl-4,4′-bisphenol F, 3,3′,5,5′-Tetramethyl-4,4′-dihydroxydiphenylmethane, 4,4′-Dihydroxy-3,3′,5,5′-tetramethyldiphenylmethane, 4,4′-Methylenebis(2,6-dimethylphenol), 4,4′-Methylenebis[2,6-dimethylphenol], 4,4′-Methylenebis[2,6-xylenol], 4,4′-Methylenedi-2,6-xylenol, BI 26X-F, Bis(3,5-dimethyl-4-hydroxyphenyl)methane, Bis(4-hydroxy-3,5-dimethylphenyl)methane, Desoxon M, NSC 128403, Phenol, 4,4′-methylenebis[2,6-dimethyl-, TMBPF; object_uuid=fo-d4ce7c638f1a6e68 |
| 262,337 | consensus_match | cas_match_labels | — | {"5384-21-4":"exactMatch"} | group_key=4,4'-methylenebis(2,6-dimethylphenol)||dimension=Environmental > media=Air > strata=Medium stack, <150 meters > population_density=Rural (<1000 people/square mile); group_sources=['ec_inventory', 'pubchem']; cas_sources={'5384-21-4': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-d4ce7c638f1a6e68: {'5384-21-4': 'exactMatch'} |
| 277,467 | opsin_iupac | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C17H20O2"]… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C17H20O2"]… | opsin_iupac: set authoritative IUPAC name, SMILES, InChI from '4,4'-methylenebis(2,6-dimethylphenol)' |
| 284,154 | rdkit_post_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C17H20O2"]… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C17H20O2"]… | rdkit_post_consensus from 'Cc1cc(Cc2cc(C)c(O)c(C)c2)cc(C)c1O'; confirmed: smiles_string, inchi2d_string, inchi2d_key_string, molecular_formula, molecular_mass, monoisotopic_mass |
| 290,229 | strip_catalogue_altlabels | altLabel | [{"@value":"2,6-Xylenol, 4,4′-methylenedi-","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wa… | [{"@value":"2,6-Xylenol, 4,4′-methylenedi-","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wa… | Removed 1 catalogue altLabel value(s): 'NSC 128403' (registry code) |
| 305,738 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/145e986a-73f4-… | associations resolved on the elementary layer |
| 391,821 | normalise_property_values | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C17H20O2"]… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C17H20O2"]… | typed the way the ontology types it |
| 400,021 | link_flows_to_their_substance | types | — | ["https://w3id.org/chemrof/NeutralMolecule"] | 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/20260821T1302361922970000/14505 | prefLabel | ef:agent/bootstrap_labels | ef:flow/145e986a-73f4-40f9-a7c3-110c97448e0a/v0 | ef:flow/145e986a-73f4-40f9-a7c3-110c97448e0a/v1 |
| ef:activity/change/20260821T1302361922970000/14506 | name | ef:agent/bootstrap_labels | ef:flow/145e986a-73f4-40f9-a7c3-110c97448e0a/v1 | ef:flow/145e986a-73f4-40f9-a7c3-110c97448e0a/v2 |
| ef:activity/change/20260821T1302361922970000/14507 | synonyms | ef:agent/bootstrap_labels | ef:flow/145e986a-73f4-40f9-a7c3-110c97448e0a/v2 | ef:flow/145e986a-73f4-40f9-a7c3-110c97448e0a/v3 |
| ef:activity/change/20260821T1302361922970000/49422 | context | ef:agent/default_context_mapping | ef:flow/145e986a-73f4-40f9-a7c3-110c97448e0a/v3 | ef:flow/145e986a-73f4-40f9-a7c3-110c97448e0a/v4 |
| ef:activity/change/20260821T1302361922970000/49423 | context_iri | ef:agent/default_context_mapping | ef:flow/145e986a-73f4-40f9-a7c3-110c97448e0a/v4 | ef:flow/145e986a-73f4-40f9-a7c3-110c97448e0a/v5 |
| ef:activity/change/20260821T1302361922970000/218127 | unit_iri | ef:agent/unit_normalization | ef:flow/145e986a-73f4-40f9-a7c3-110c97448e0a/v5 | ef:flow/145e986a-73f4-40f9-a7c3-110c97448e0a/v6 |
| ef:activity/change/20260821T1302361922970000/240915 | properties | ef:agent/enrich_references | ef:flow/145e986a-73f4-40f9-a7c3-110c97448e0a/v6 | ef:flow/145e986a-73f4-40f9-a7c3-110c97448e0a/v7 |
| ef:activity/change/20260821T1302361922970000/240916 | skos_definition | ef:agent/enrich_references | ef:flow/145e986a-73f4-40f9-a7c3-110c97448e0a/v7 | ef:flow/145e986a-73f4-40f9-a7c3-110c97448e0a/v8 |
| ef:activity/change/20260821T1302361922970000/240917 | references | ef:agent/enrich_references | ef:flow/145e986a-73f4-40f9-a7c3-110c97448e0a/v8 | ef:flow/145e986a-73f4-40f9-a7c3-110c97448e0a/v9 |
| ef:activity/change/20260821T1302361922970000/252273 | properties | ef:agent/rdkit_pre_consensus | ef:flow/145e986a-73f4-40f9-a7c3-110c97448e0a/v9 | ef:flow/145e986a-73f4-40f9-a7c3-110c97448e0a/v10 |
| ef:activity/change/20260821T1302361922970000/262336 | altLabel | ef:agent/consensus_match | ef:flow/145e986a-73f4-40f9-a7c3-110c97448e0a/v10 | ef:flow/145e986a-73f4-40f9-a7c3-110c97448e0a/v11 |
| ef:activity/change/20260821T1302361922970000/262337 | cas_match_labels | ef:agent/consensus_match | ef:flow/145e986a-73f4-40f9-a7c3-110c97448e0a/v11 | ef:flow/145e986a-73f4-40f9-a7c3-110c97448e0a/v12 |
| ef:activity/change/20260821T1302361922970000/277467 | properties | ef:agent/opsin_iupac | ef:flow/145e986a-73f4-40f9-a7c3-110c97448e0a/v12 | ef:flow/145e986a-73f4-40f9-a7c3-110c97448e0a/v13 |
| ef:activity/change/20260821T1302361922970000/284154 | properties | ef:agent/rdkit_post_consensus | ef:flow/145e986a-73f4-40f9-a7c3-110c97448e0a/v13 | ef:flow/145e986a-73f4-40f9-a7c3-110c97448e0a/v14 |
| ef:activity/change/20260821T1302361922970000/290229 | altLabel | ef:agent/strip_catalogue_altlabels | ef:flow/145e986a-73f4-40f9-a7c3-110c97448e0a/v14 | ef:flow/145e986a-73f4-40f9-a7c3-110c97448e0a/v15 |
| ef:activity/change/20260821T1302361922970000/305738 | concept_associations | ef:agent/carry_associations_onto_flows | ef:flow/145e986a-73f4-40f9-a7c3-110c97448e0a/v15 | ef:flow/145e986a-73f4-40f9-a7c3-110c97448e0a/v16 |
| ef:activity/change/20260821T1302361922970000/391821 | properties | ef:agent/normalise_property_values | ef:flow/145e986a-73f4-40f9-a7c3-110c97448e0a/v16 | ef:flow/145e986a-73f4-40f9-a7c3-110c97448e0a/v17 |
| ef:activity/change/20260821T1302361922970000/400021 | types | ef:agent/link_flows_to_their_substance | ef:flow/145e986a-73f4-40f9-a7c3-110c97448e0a/v17 | ef:flow/145e986a-73f4-40f9-a7c3-110c97448e0a/v18 |