2,4-dichlorophenoxyacetic Acid, Isooctyl Ester
Everything that changed this flow. Back to the flow
3c258f50-ded0-482d-afb4-241a0902d598
By field
14 fields| Field | Changes | Written by | Latest note |
|---|---|---|---|
| properties | 5 | enrich_references, opsin_iupac, rdkit_post_consensus, rdkit_pre_consensus, withhold_ambiguous_mass | withhold_ambiguous_mass: removed molecular_mass, monoisotopic_mass; the flow carries 2 candidate structures, so no one mass describes it |
| prefLabel | 2 | bootstrap_labels, normalize_name_case | Title-cased words without internal capitals (preserved words with uppercase letters beyond the first character) |
| altLabel | 1 | consensus_match | group_key=2,4-dichlorophenoxyaceticacid,isooctylester||dimension=Environmental > media=Air > indoor=Unknown; cas=25168-26-7; added Common Chemistry CAS names as altLabel: 2,4-D Isoctyl, 2,4-D ester, 2,4-D isooctyl ester, 2,4-Dichlorophenoxyacetic acid isooctyl ester, Acetic acid, (2,4-dichlorophenoxy)-, isooctyl ester, Acetic acid, 2-(2,4-dichlorophenoxy)-, isooctyl ester, Agro-D-Ester, Agroxone 5, Esteron, Isooctyl 2,4-dichlorophenoxyacetate, Isooctyl alcohol, (2,4-dichlorophenoxy)acetate, Silvapron D; object_uuid=fo-be3a11ddbcb50f13 |
| cas_match_labels | 1 | consensus_match | group_key=2,4-dichlorophenoxyaceticacid,isooctylester||dimension=Environmental > media=Air > indoor=Unknown; group_sources=['ec_inventory']; cas_sources={'25168-26-7': ['ec_inventory']}; assigned CAS labels from group consensus; object_uuid=fo-be3a11ddbcb50f13: {'25168-26-7': '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 air > Emissions to air, indoor |
| context_iri | 1 | default_context_mapping | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to air > Emissions to air, indoor |
| ec_numbers | 1 | ec_cross_check | Resolved from EC-inventory: 246-704-3 from CAS 25168-26-7 |
| name | 1 | bootstrap_labels | Purged legacy name field to enforce prefLabel usage |
| references | 1 | enrich_references | Added references with provenance; cas_numbers=['25168-26-7']; matched_chebi_ids=[]; candidate_pubchem_cids=[24678, 61286, 176514736]; selected_pubchem_cids=[24678, 176514736]; 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
19| # | Step | Field | From | To | Why |
|---|---|---|---|---|---|
| 21,521 | bootstrap_labels | prefLabel | — | [{"@value":"2,4-dichlorophenoxyacetic acid, isooctyl ester","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap… | Bootstrapped prefLabel from legacy name field |
| 21,522 | bootstrap_labels | name | 2,4-dichlorophenoxyacetic acid, isooctyl ester | — | Purged legacy name field to enforce prefLabel usage |
| 21,523 | bootstrap_labels | synonyms | ["(2,4-Dichlorophenoxy)acetic acid 2-ethylhexyl ester","2,4-D 2-Ethylhexyl ester","2,4-D-2-ethylhexyl","2-Ethylhexyl (2… | [] | Removed legacy synonyms field in favor of structured labels |
| 76,314 | default_context_mapping | context | — | {"dimension":"Environmental","media":"Air","indoor":"Unknown"} | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to air > Emissions to air, indoor |
| 76,315 | default_context_mapping | context_iri | — | https://vocab.brightway.one/flow-contexts/envi-air-indr-unkn | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to air > Emissions to air, indoor |
| 220,239 | unit_normalization | unit_iri | — | https://vocab.brightway.one/units/unit/KiloGM | Unit IRI set from normalization of 'kg' |
| 225,956 | normalize_name_case | prefLabel | [{"@value":"2,4-dichlorophenoxyacetic acid, isooctyl ester","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap… | [{"@value":"2,4-dichlorophenoxyacetic Acid, Isooctyl Ester","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap… | Title-cased words without internal capitals (preserved words with uppercase letters beyond the first character) |
| 227,054 | ec_cross_check | ec_numbers | [] | ["246-704-3"] | Resolved from EC-inventory: 246-704-3 from CAS 25168-26-7 |
| 246,821 | enrich_references | properties | {} | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C16H22Cl2O… | Added ChEBI/PubChem properties (chebi_ids=0, pubchem_cids=2) |
| 246,822 | enrich_references | skos_definition | — | [] | Merged ChEBI/PubChem definitions into skos:definition |
| 246,823 | enrich_references | references | [] | [{"@id":"http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J33.455C","provenance":{"prov:wasGeneratedBy":"enrich_referenc… | Added references with provenance; cas_numbers=['25168-26-7']; matched_chebi_ids=[]; candidate_pubchem_cids=[24678, 61286, 176514736]; selected_pubchem_cids=[24678, 176514736]; 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 |
| 253,986 | rdkit_pre_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C16H22Cl2O… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C16H22Cl2O… | rdkit_pre_consensus from 'CC(C)CCCCCOC(=O)COC1=C(C=C(C=C1)Cl)Cl'; added: molecular_mass, monoisotopic_mass |
| 259,934 | consensus_match | altLabel | [] | [{"@value":"2,4-D Isoctyl","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"c… | group_key=2,4-dichlorophenoxyaceticacid,isooctylester||dimension=Environmental > media=Air > indoor=Unknown; cas=25168-26-7; added Common Chemistry CAS names as altLabel: 2,4-D Isoctyl, 2,4-D ester, 2,4-D isooctyl ester, 2,4-Dichlorophenoxyacetic acid isooctyl ester, Acetic acid, (2,4-dichlorophenoxy)-, isooctyl ester, Acetic acid, 2-(2,4-dichlorophenoxy)-, isooctyl ester, Agro-D-Ester, Agroxone 5, Esteron, Isooctyl 2,4-dichlorophenoxyacetate, Isooctyl alcohol, (2,4-dichlorophenoxy)acetate, Silvapron D; object_uuid=fo-be3a11ddbcb50f13 |
| 259,935 | consensus_match | cas_match_labels | — | {"25168-26-7":"exactMatch"} | group_key=2,4-dichlorophenoxyaceticacid,isooctylester||dimension=Environmental > media=Air > indoor=Unknown; group_sources=['ec_inventory']; cas_sources={'25168-26-7': ['ec_inventory']}; assigned CAS labels from group consensus; object_uuid=fo-be3a11ddbcb50f13: {'25168-26-7': 'exactMatch'} |
| 279,173 | opsin_iupac | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C16H22Cl2O… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C16H22Cl2O… | opsin_iupac: set authoritative IUPAC name, SMILES, InChI from '2,4-dichlorophenoxyacetic Acid, Isooctyl Ester' |
| 286,029 | rdkit_post_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C16H22Cl2O… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C16H22Cl2O… | rdkit_post_consensus from 'CC(C)CCCCCOC(=O)COc1ccc(Cl)cc1Cl'; confirmed: smiles_string, inchi2d_string, inchi2d_key_string, molecular_formula, molecular_mass, monoisotopic_mass |
| 287,202 | withhold_ambiguous_mass | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C16H22Cl2O… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C16H22Cl2O… | withhold_ambiguous_mass: removed molecular_mass, monoisotopic_mass; the flow carries 2 candidate structures, so no one mass describes it |
| 319,165 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/3c258f50-ded0-… | associations resolved on the elementary layer |
| 402,616 | 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/20260821T0609040591070000/21521 | prefLabel | ef:agent/bootstrap_labels | ef:flow/3c258f50-ded0-482d-afb4-241a0902d598/v0 | ef:flow/3c258f50-ded0-482d-afb4-241a0902d598/v1 |
| ef:activity/change/20260821T0609040591070000/21522 | name | ef:agent/bootstrap_labels | ef:flow/3c258f50-ded0-482d-afb4-241a0902d598/v1 | ef:flow/3c258f50-ded0-482d-afb4-241a0902d598/v2 |
| ef:activity/change/20260821T0609040591070000/21523 | synonyms | ef:agent/bootstrap_labels | ef:flow/3c258f50-ded0-482d-afb4-241a0902d598/v2 | ef:flow/3c258f50-ded0-482d-afb4-241a0902d598/v3 |
| ef:activity/change/20260821T0609040591070000/76314 | context | ef:agent/default_context_mapping | ef:flow/3c258f50-ded0-482d-afb4-241a0902d598/v3 | ef:flow/3c258f50-ded0-482d-afb4-241a0902d598/v4 |
| ef:activity/change/20260821T0609040591070000/76315 | context_iri | ef:agent/default_context_mapping | ef:flow/3c258f50-ded0-482d-afb4-241a0902d598/v4 | ef:flow/3c258f50-ded0-482d-afb4-241a0902d598/v5 |
| ef:activity/change/20260821T0609040591070000/220239 | unit_iri | ef:agent/unit_normalization | ef:flow/3c258f50-ded0-482d-afb4-241a0902d598/v5 | ef:flow/3c258f50-ded0-482d-afb4-241a0902d598/v6 |
| ef:activity/change/20260821T0609040591070000/225956 | prefLabel | ef:agent/normalize_name_case | ef:flow/3c258f50-ded0-482d-afb4-241a0902d598/v6 | ef:flow/3c258f50-ded0-482d-afb4-241a0902d598/v7 |
| ef:activity/change/20260821T0609040591070000/227054 | ec_numbers | ef:agent/ec_cross_check | ef:flow/3c258f50-ded0-482d-afb4-241a0902d598/v7 | ef:flow/3c258f50-ded0-482d-afb4-241a0902d598/v8 |
| ef:activity/change/20260821T0609040591070000/246821 | properties | ef:agent/enrich_references | ef:flow/3c258f50-ded0-482d-afb4-241a0902d598/v8 | ef:flow/3c258f50-ded0-482d-afb4-241a0902d598/v9 |
| ef:activity/change/20260821T0609040591070000/246822 | skos_definition | ef:agent/enrich_references | ef:flow/3c258f50-ded0-482d-afb4-241a0902d598/v9 | ef:flow/3c258f50-ded0-482d-afb4-241a0902d598/v10 |
| ef:activity/change/20260821T0609040591070000/246823 | references | ef:agent/enrich_references | ef:flow/3c258f50-ded0-482d-afb4-241a0902d598/v10 | ef:flow/3c258f50-ded0-482d-afb4-241a0902d598/v11 |
| ef:activity/change/20260821T0609040591070000/253986 | properties | ef:agent/rdkit_pre_consensus | ef:flow/3c258f50-ded0-482d-afb4-241a0902d598/v11 | ef:flow/3c258f50-ded0-482d-afb4-241a0902d598/v12 |
| ef:activity/change/20260821T0609040591070000/259934 | altLabel | ef:agent/consensus_match | ef:flow/3c258f50-ded0-482d-afb4-241a0902d598/v12 | ef:flow/3c258f50-ded0-482d-afb4-241a0902d598/v13 |
| ef:activity/change/20260821T0609040591070000/259935 | cas_match_labels | ef:agent/consensus_match | ef:flow/3c258f50-ded0-482d-afb4-241a0902d598/v13 | ef:flow/3c258f50-ded0-482d-afb4-241a0902d598/v14 |
| ef:activity/change/20260821T0609040591070000/279173 | properties | ef:agent/opsin_iupac | ef:flow/3c258f50-ded0-482d-afb4-241a0902d598/v14 | ef:flow/3c258f50-ded0-482d-afb4-241a0902d598/v15 |
| ef:activity/change/20260821T0609040591070000/286029 | properties | ef:agent/rdkit_post_consensus | ef:flow/3c258f50-ded0-482d-afb4-241a0902d598/v15 | ef:flow/3c258f50-ded0-482d-afb4-241a0902d598/v16 |
| ef:activity/change/20260821T0609040591070000/287202 | properties | ef:agent/withhold_ambiguous_mass | ef:flow/3c258f50-ded0-482d-afb4-241a0902d598/v16 | ef:flow/3c258f50-ded0-482d-afb4-241a0902d598/v17 |
| ef:activity/change/20260821T0609040591070000/319165 | concept_associations | ef:agent/carry_associations_onto_flows | ef:flow/3c258f50-ded0-482d-afb4-241a0902d598/v17 | ef:flow/3c258f50-ded0-482d-afb4-241a0902d598/v18 |
| ef:activity/change/20260821T0609040591070000/402616 | types | ef:agent/link_flows_to_their_substance | ef:flow/3c258f50-ded0-482d-afb4-241a0902d598/v18 | ef:flow/3c258f50-ded0-482d-afb4-241a0902d598/v19 |