4-tert-butylbenzene-1,2-diol
Everything that changed this flow. Back to the flow
0180e4c8-2eb2-42db-bc89-382653911ad0
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 4 catalogue altLabel value(s): 'NLC 10' (grade code), 'NSC 5310' (registry code), 'Norpol 9853' (trade name), 'Norpol Inhibitor 9853' (trade name) |
| cas_match_labels | 1 | consensus_match | group_key=4-tert-butylbenzene-1,2-diol||dimension=Environmental > media=Ground > geography=Non-agricultural; group_sources=['ec_inventory', 'pubchem']; cas_sources={'98-29-3': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-5d0bbc7eac117bfc: {'98-29-3': '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 soil > Emissions to non-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 non-agricultural soil |
| 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=['98-29-3']; matched_chebi_ids=[]; candidate_pubchem_cids=[7381, 70215]; selected_pubchem_cids=[7381]; 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 |
|---|---|---|---|---|---|
| 1,283 | bootstrap_labels | prefLabel | — | [{"@value":"4-tert-butylbenzene-1,2-diol","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:was… | Bootstrapped prefLabel from legacy name field |
| 1,284 | bootstrap_labels | name | 4-tert-butylbenzene-1,2-diol | — | Purged legacy name field to enforce prefLabel usage |
| 1,285 | bootstrap_labels | synonyms | ["organic","4-tert-butylpyrocatechol"] | [] | Removed legacy synonyms field in favor of structured labels |
| 26,786 | default_context_mapping | context | — | {"dimension":"Environmental","media":"Ground","geography":"Non-agricultural"} | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to soil > Emissions to non-agricultural soil |
| 26,787 | default_context_mapping | context_iri | — | https://vocab.brightway.one/flow-contexts/envi-grou-noag | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to soil > Emissions to non-agricultural soil |
| 213,769 | unit_normalization | unit_iri | — | https://vocab.brightway.one/units/unit/KiloGM | Unit IRI set from normalization of 'kg' |
| 228,417 | enrich_references | properties | {} | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C10H14O2"]… | Added ChEBI/PubChem properties (chebi_ids=0, pubchem_cids=1) |
| 228,418 | enrich_references | skos_definition | — | [] | Merged ChEBI/PubChem definitions into skos:definition |
| 228,419 | enrich_references | references | [] | [{"@id":"http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J21.591K","provenance":{"prov:wasGeneratedBy":"enrich_referenc… | Added references with provenance; cas_numbers=['98-29-3']; matched_chebi_ids=[]; candidate_pubchem_cids=[7381, 70215]; selected_pubchem_cids=[7381]; 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 |
| 248,679 | rdkit_pre_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C10H14O2"]… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C10H14O2"]… | rdkit_pre_consensus from 'CC(C)(C)C1=CC(=C(C=C1)O)O'; added: molecular_mass, monoisotopic_mass |
| 262,948 | consensus_match | altLabel | [] | [{"@value":"1,2-Benzenediol, 4-(1,1-dimethylethyl)-","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match"… | group_key=4-tert-butylbenzene-1,2-diol||dimension=Environmental > media=Ground > geography=Non-agricultural; cas=98-29-3; added Common Chemistry CAS names as altLabel: 1,2-Benzenediol, 4-(1,1-dimethylethyl)-, 1,2-Dihydroxy-4-<em>tert</em>-butylbenzene, 4-(1,1-Dimethylethyl)-1,2-benzenediol, 4-(1,1-Dimethylethyl)benzene-1,2-diol, 4-(1,1-Dimethylethyl)catechol, 4-<em>tert</em>-Butyl-1,2-benzenediol, 4-<em>tert</em>-Butyl-1,2-dihydroxybenzene, 4-<em>tert</em>-Butyl-<em>o</em>-catechol, 4-<em>tert</em>-Butylcatechin, 4-<em>tert</em>-Butylcatechol, 4-<em>tert</em>-Butylpyrocatechol, 4-TBC, 5-<em>tert</em>-Butylcatechol, <em>p</em>-<em>t</em>-Butylcatechol, <em>p</em>-<em>tert</em>-Butylcatechol, <em>p</em>-<em>tert</em>-Butylpyrocatechol, DIC-TBC 5P, Inhibitor NLC 10, NLC 10, NSC 5310, Norpol 9853, Norpol Inhibitor 9853, Pyrocatechol, 4-<em>tert</em>-butyl-, Q-TBC 5P, Q-TBC-5P, TBC; object_uuid=fo-5d0bbc7eac117bfc |
| 262,949 | consensus_match | cas_match_labels | — | {"98-29-3":"exactMatch"} | group_key=4-tert-butylbenzene-1,2-diol||dimension=Environmental > media=Ground > geography=Non-agricultural; group_sources=['ec_inventory', 'pubchem']; cas_sources={'98-29-3': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-5d0bbc7eac117bfc: {'98-29-3': 'exactMatch'} |
| 273,814 | opsin_iupac | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C10H14O2"]… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C10H14O2"]… | opsin_iupac: set authoritative IUPAC name, SMILES, InChI from '4-tert-butylbenzene-1,2-diol' |
| 280,197 | rdkit_post_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C10H14O2"]… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C10H14O2"]… | rdkit_post_consensus from 'CC(C)(C)c1ccc(O)c(O)c1'; confirmed: smiles_string, inchi2d_string, inchi2d_key_string, molecular_formula, molecular_mass, monoisotopic_mass |
| 287,536 | strip_catalogue_altlabels | altLabel | [{"@value":"1,2-Benzenediol, 4-(1,1-dimethylethyl)-","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match"… | [{"@value":"1,2-Benzenediol, 4-(1,1-dimethylethyl)-","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match"… | Removed 4 catalogue altLabel value(s): 'NLC 10' (grade code), 'NSC 5310' (registry code), 'Norpol 9853' (trade name), 'Norpol Inhibitor 9853' (trade name) |
| 294,457 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/0180e4c8-2eb2-… | associations resolved on the elementary layer |
| 388,098 | normalise_property_values | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C10H14O2"]… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C10H14O2"]… | typed the way the ontology types it |
| 394,695 | 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/20260820T1416470405690000/1283 | prefLabel | ef:agent/bootstrap_labels | ef:flow/0180e4c8-2eb2-42db-bc89-382653911ad0/v0 | ef:flow/0180e4c8-2eb2-42db-bc89-382653911ad0/v1 |
| ef:activity/change/20260820T1416470405690000/1284 | name | ef:agent/bootstrap_labels | ef:flow/0180e4c8-2eb2-42db-bc89-382653911ad0/v1 | ef:flow/0180e4c8-2eb2-42db-bc89-382653911ad0/v2 |
| ef:activity/change/20260820T1416470405690000/1285 | synonyms | ef:agent/bootstrap_labels | ef:flow/0180e4c8-2eb2-42db-bc89-382653911ad0/v2 | ef:flow/0180e4c8-2eb2-42db-bc89-382653911ad0/v3 |
| ef:activity/change/20260820T1416470405690000/26786 | context | ef:agent/default_context_mapping | ef:flow/0180e4c8-2eb2-42db-bc89-382653911ad0/v3 | ef:flow/0180e4c8-2eb2-42db-bc89-382653911ad0/v4 |
| ef:activity/change/20260820T1416470405690000/26787 | context_iri | ef:agent/default_context_mapping | ef:flow/0180e4c8-2eb2-42db-bc89-382653911ad0/v4 | ef:flow/0180e4c8-2eb2-42db-bc89-382653911ad0/v5 |
| ef:activity/change/20260820T1416470405690000/213769 | unit_iri | ef:agent/unit_normalization | ef:flow/0180e4c8-2eb2-42db-bc89-382653911ad0/v5 | ef:flow/0180e4c8-2eb2-42db-bc89-382653911ad0/v6 |
| ef:activity/change/20260820T1416470405690000/228417 | properties | ef:agent/enrich_references | ef:flow/0180e4c8-2eb2-42db-bc89-382653911ad0/v6 | ef:flow/0180e4c8-2eb2-42db-bc89-382653911ad0/v7 |
| ef:activity/change/20260820T1416470405690000/228418 | skos_definition | ef:agent/enrich_references | ef:flow/0180e4c8-2eb2-42db-bc89-382653911ad0/v7 | ef:flow/0180e4c8-2eb2-42db-bc89-382653911ad0/v8 |
| ef:activity/change/20260820T1416470405690000/228419 | references | ef:agent/enrich_references | ef:flow/0180e4c8-2eb2-42db-bc89-382653911ad0/v8 | ef:flow/0180e4c8-2eb2-42db-bc89-382653911ad0/v9 |
| ef:activity/change/20260820T1416470405690000/248679 | properties | ef:agent/rdkit_pre_consensus | ef:flow/0180e4c8-2eb2-42db-bc89-382653911ad0/v9 | ef:flow/0180e4c8-2eb2-42db-bc89-382653911ad0/v10 |
| ef:activity/change/20260820T1416470405690000/262948 | altLabel | ef:agent/consensus_match | ef:flow/0180e4c8-2eb2-42db-bc89-382653911ad0/v10 | ef:flow/0180e4c8-2eb2-42db-bc89-382653911ad0/v11 |
| ef:activity/change/20260820T1416470405690000/262949 | cas_match_labels | ef:agent/consensus_match | ef:flow/0180e4c8-2eb2-42db-bc89-382653911ad0/v11 | ef:flow/0180e4c8-2eb2-42db-bc89-382653911ad0/v12 |
| ef:activity/change/20260820T1416470405690000/273814 | properties | ef:agent/opsin_iupac | ef:flow/0180e4c8-2eb2-42db-bc89-382653911ad0/v12 | ef:flow/0180e4c8-2eb2-42db-bc89-382653911ad0/v13 |
| ef:activity/change/20260820T1416470405690000/280197 | properties | ef:agent/rdkit_post_consensus | ef:flow/0180e4c8-2eb2-42db-bc89-382653911ad0/v13 | ef:flow/0180e4c8-2eb2-42db-bc89-382653911ad0/v14 |
| ef:activity/change/20260820T1416470405690000/287536 | altLabel | ef:agent/strip_catalogue_altlabels | ef:flow/0180e4c8-2eb2-42db-bc89-382653911ad0/v14 | ef:flow/0180e4c8-2eb2-42db-bc89-382653911ad0/v15 |
| ef:activity/change/20260820T1416470405690000/294457 | concept_associations | ef:agent/carry_associations_onto_flows | ef:flow/0180e4c8-2eb2-42db-bc89-382653911ad0/v15 | ef:flow/0180e4c8-2eb2-42db-bc89-382653911ad0/v16 |
| ef:activity/change/20260820T1416470405690000/388098 | properties | ef:agent/normalise_property_values | ef:flow/0180e4c8-2eb2-42db-bc89-382653911ad0/v16 | ef:flow/0180e4c8-2eb2-42db-bc89-382653911ad0/v17 |
| ef:activity/change/20260820T1416470405690000/394695 | types | ef:agent/link_flows_to_their_substance | ef:flow/0180e4c8-2eb2-42db-bc89-382653911ad0/v17 | ef:flow/0180e4c8-2eb2-42db-bc89-382653911ad0/v18 |