1,3-benzenediamine
Everything that changed this flow. Back to the flow
064591e0-b497-4575-a0e5-5f71cfa772ac
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, dedupe_altlabels | Deduplicated altLabel values and removed entries matching prefLabel |
| cas_match_labels | 1 | consensus_match | group_key=1,3-benzenediamine||dimension=Environmental > media=Water > water_body=Unknown; group_sources=['ec_inventory']; cas_sources={'541-69-5': ['ec_inventory']}; assigned CAS labels from group consensus; object_uuid=fo-a0c63884718b5d6a: {'541-69-5': '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 |
| 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=['541-69-5']; matched_chebi_ids=[]; candidate_pubchem_cids=[10941, 12205, 6365246]; selected_pubchem_cids=[10941]; 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 |
|---|---|---|---|---|---|
| 5,172 | bootstrap_labels | prefLabel | — | [{"@value":"1,3-benzenediamine","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:wasAttributed… | Bootstrapped prefLabel from legacy name field |
| 5,173 | bootstrap_labels | name | 1,3-benzenediamine | — | Purged legacy name field to enforce prefLabel usage |
| 5,174 | bootstrap_labels | synonyms | ["m-phenylenediamine","m-phenylenediaminedihydrochloride","1,3-phenylenediaminedihydrochloride","benzene-1,3-diamine","… | [] | Removed legacy synonyms field in favor of structured labels |
| 30,490 | 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 |
| 30,491 | 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 |
| 215,067 | unit_normalization | unit_iri | — | https://vocab.brightway.one/units/unit/KiloGM | Unit IRI set from normalization of 'kg' |
| 232,153 | enrich_references | properties | {} | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C6H10Cl2N2… | Added ChEBI/PubChem properties (chebi_ids=0, pubchem_cids=1) |
| 232,154 | enrich_references | skos_definition | — | [] | Merged ChEBI/PubChem definitions into skos:definition |
| 232,155 | enrich_references | references | [] | [{"@id":"https://chem.echa.europa.eu/100.007.992","provenance":{"prov:wasGeneratedBy":"enrich_references.pubchem_identi… | Added references with provenance; cas_numbers=['541-69-5']; matched_chebi_ids=[]; candidate_pubchem_cids=[10941, 12205, 6365246]; selected_pubchem_cids=[10941]; 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 |
| 249,743 | rdkit_pre_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C6H10Cl2N2… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C6H10Cl2N2… | rdkit_pre_consensus from 'C1=CC(=CC(=C1)N)N.Cl.Cl'; added: molecular_mass, monoisotopic_mass |
| 258,498 | consensus_match | altLabel | [] | [{"@value":"1,3-Benzenediamine, dihydrochloride","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","pr… | group_key=1,3-benzenediamine||dimension=Environmental > media=Water > water_body=Unknown; cas=541-69-5; added Common Chemistry CAS names as altLabel: 1,3-Benzenediamine, dihydrochloride, 1,3-Benzenediamine, hydrochloride (1:2), 1,3-Diaminobenzene dihydrochloride, 1,3-Phenylenediamine dihydrochloride, <em>m</em>-Phenylenediamine hydrochloride, <em>m</em>-Phenylenediamine, dihydrochloride, <em>m</em>-Phenylenediammonium dichloride; object_uuid=fo-a0c63884718b5d6a |
| 258,499 | consensus_match | cas_match_labels | — | {"541-69-5":"exactMatch"} | group_key=1,3-benzenediamine||dimension=Environmental > media=Water > water_body=Unknown; group_sources=['ec_inventory']; cas_sources={'541-69-5': ['ec_inventory']}; assigned CAS labels from group consensus; object_uuid=fo-a0c63884718b5d6a: {'541-69-5': 'exactMatch'} |
| 274,881 | opsin_iupac | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C6H10Cl2N2… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C6H10Cl2N2… | opsin_iupac: set authoritative IUPAC name, SMILES, InChI from '1,3-Benzenediamine, dihydrochloride' |
| 281,351 | rdkit_post_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C6H10Cl2N2… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C6H10Cl2N2… | rdkit_post_consensus from 'Cl.Cl.Nc1cccc(N)c1'; confirmed: smiles_string, inchi2d_string, inchi2d_key_string, molecular_formula, molecular_mass, monoisotopic_mass |
| 292,235 | dedupe_altlabels | altLabel | [{"@value":"1,3-Benzenediamine, dihydrochloride","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","pr… | [{"@value":"1,3-Benzenediamine, dihydrochloride","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","pr… | Deduplicated altLabel values and removed entries matching prefLabel |
| 296,277 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/064591e0-b497-… | associations resolved on the elementary layer |
| 389,181 | normalise_property_values | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C6H10Cl2N2… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C6H10Cl2N2… | typed the way the ontology types it |
| 396,225 | 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/20260820T1812399309960000/5172 | prefLabel | ef:agent/bootstrap_labels | ef:flow/064591e0-b497-4575-a0e5-5f71cfa772ac/v0 | ef:flow/064591e0-b497-4575-a0e5-5f71cfa772ac/v1 |
| ef:activity/change/20260820T1812399309960000/5173 | name | ef:agent/bootstrap_labels | ef:flow/064591e0-b497-4575-a0e5-5f71cfa772ac/v1 | ef:flow/064591e0-b497-4575-a0e5-5f71cfa772ac/v2 |
| ef:activity/change/20260820T1812399309960000/5174 | synonyms | ef:agent/bootstrap_labels | ef:flow/064591e0-b497-4575-a0e5-5f71cfa772ac/v2 | ef:flow/064591e0-b497-4575-a0e5-5f71cfa772ac/v3 |
| ef:activity/change/20260820T1812399309960000/30490 | context | ef:agent/default_context_mapping | ef:flow/064591e0-b497-4575-a0e5-5f71cfa772ac/v3 | ef:flow/064591e0-b497-4575-a0e5-5f71cfa772ac/v4 |
| ef:activity/change/20260820T1812399309960000/30491 | context_iri | ef:agent/default_context_mapping | ef:flow/064591e0-b497-4575-a0e5-5f71cfa772ac/v4 | ef:flow/064591e0-b497-4575-a0e5-5f71cfa772ac/v5 |
| ef:activity/change/20260820T1812399309960000/215067 | unit_iri | ef:agent/unit_normalization | ef:flow/064591e0-b497-4575-a0e5-5f71cfa772ac/v5 | ef:flow/064591e0-b497-4575-a0e5-5f71cfa772ac/v6 |
| ef:activity/change/20260820T1812399309960000/232153 | properties | ef:agent/enrich_references | ef:flow/064591e0-b497-4575-a0e5-5f71cfa772ac/v6 | ef:flow/064591e0-b497-4575-a0e5-5f71cfa772ac/v7 |
| ef:activity/change/20260820T1812399309960000/232154 | skos_definition | ef:agent/enrich_references | ef:flow/064591e0-b497-4575-a0e5-5f71cfa772ac/v7 | ef:flow/064591e0-b497-4575-a0e5-5f71cfa772ac/v8 |
| ef:activity/change/20260820T1812399309960000/232155 | references | ef:agent/enrich_references | ef:flow/064591e0-b497-4575-a0e5-5f71cfa772ac/v8 | ef:flow/064591e0-b497-4575-a0e5-5f71cfa772ac/v9 |
| ef:activity/change/20260820T1812399309960000/249743 | properties | ef:agent/rdkit_pre_consensus | ef:flow/064591e0-b497-4575-a0e5-5f71cfa772ac/v9 | ef:flow/064591e0-b497-4575-a0e5-5f71cfa772ac/v10 |
| ef:activity/change/20260820T1812399309960000/258498 | altLabel | ef:agent/consensus_match | ef:flow/064591e0-b497-4575-a0e5-5f71cfa772ac/v10 | ef:flow/064591e0-b497-4575-a0e5-5f71cfa772ac/v11 |
| ef:activity/change/20260820T1812399309960000/258499 | cas_match_labels | ef:agent/consensus_match | ef:flow/064591e0-b497-4575-a0e5-5f71cfa772ac/v11 | ef:flow/064591e0-b497-4575-a0e5-5f71cfa772ac/v12 |
| ef:activity/change/20260820T1812399309960000/274881 | properties | ef:agent/opsin_iupac | ef:flow/064591e0-b497-4575-a0e5-5f71cfa772ac/v12 | ef:flow/064591e0-b497-4575-a0e5-5f71cfa772ac/v13 |
| ef:activity/change/20260820T1812399309960000/281351 | properties | ef:agent/rdkit_post_consensus | ef:flow/064591e0-b497-4575-a0e5-5f71cfa772ac/v13 | ef:flow/064591e0-b497-4575-a0e5-5f71cfa772ac/v14 |
| ef:activity/change/20260820T1812399309960000/292235 | altLabel | ef:agent/dedupe_altlabels | ef:flow/064591e0-b497-4575-a0e5-5f71cfa772ac/v14 | ef:flow/064591e0-b497-4575-a0e5-5f71cfa772ac/v15 |
| ef:activity/change/20260820T1812399309960000/296277 | concept_associations | ef:agent/carry_associations_onto_flows | ef:flow/064591e0-b497-4575-a0e5-5f71cfa772ac/v15 | ef:flow/064591e0-b497-4575-a0e5-5f71cfa772ac/v16 |
| ef:activity/change/20260820T1812399309960000/389181 | properties | ef:agent/normalise_property_values | ef:flow/064591e0-b497-4575-a0e5-5f71cfa772ac/v16 | ef:flow/064591e0-b497-4575-a0e5-5f71cfa772ac/v17 |
| ef:activity/change/20260820T1812399309960000/396225 | types | ef:agent/link_flows_to_their_substance | ef:flow/064591e0-b497-4575-a0e5-5f71cfa772ac/v17 | ef:flow/064591e0-b497-4575-a0e5-5f71cfa772ac/v18 |