1-chloro-3-nitrobenzene
Everything that changed this flow. Back to the flow
e574190c-95c9-4191-b35f-d28c05b70105
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 | 3 | chebi_altlabels, consensus_match, strip_catalogue_altlabels | Removed 1 catalogue altLabel value(s): 'NSC 5502' (registry code) |
| cas_match_labels | 1 | consensus_match | group_key=1-chloro-3-nitrobenzene||dimension=Environmental > media=Air > strata=Aircraft cruise height; group_sources=['chebi', 'ec_inventory', 'pubchem']; cas_sources={'121-73-3': ['chebi', 'ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-34a9e4c74b55edb5: {'121-73-3': '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 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 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=['121-73-3']; matched_chebi_ids=['http://purl.obolibrary.org/obo/CHEBI_82420']; candidate_pubchem_cids=[8489, 184252]; selected_pubchem_cids=[8489]; 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 |
|---|---|---|---|---|---|
| 5,840 | bootstrap_labels | prefLabel | — | [{"@value":"1-chloro-3-nitrobenzene","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:wasAttri… | Bootstrapped prefLabel from legacy name field |
| 5,841 | bootstrap_labels | name | 1-chloro-3-nitrobenzene | — | Purged legacy name field to enforce prefLabel usage |
| 18,760 | bootstrap_labels | synonyms | ["1-Chloronitrobenzene","1-Nitro-3-chlorobenzene","3-Chloro-1-nitrobenzene","3-Chloronitrobenzene","3-Nitrochlorobenzen… | [] | Removed legacy synonyms field in favor of structured labels |
| 187,174 | default_context_mapping | context | — | {"dimension":"Environmental","media":"Ground","geography":"Agricultural"} | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to soil > Emissions to agricultural soil |
| 187,175 | default_context_mapping | context_iri | — | https://vocab.brightway.one/flow-contexts/envi-grou-agri | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to soil > Emissions to agricultural soil |
| 215,289 | unit_normalization | unit_iri | — | https://vocab.brightway.one/units/unit/KiloGM | Unit IRI set from normalization of 'kg' |
| 232,799 | enrich_references | properties | {} | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C6H4ClNO2"… | Added ChEBI/PubChem properties (chebi_ids=1, pubchem_cids=1) |
| 232,800 | enrich_references | skos_definition | — | [{"@value":"A C-nitro compound that is nitrobenzene in which one of the meta- hydrogens has been replaced by chlorine."… | Merged ChEBI/PubChem definitions into skos:definition |
| 232,801 | enrich_references | references | [] | [{"@id":"http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J2.489I","provenance":{"prov:wasGeneratedBy":"enrich_reference… | Added references with provenance; cas_numbers=['121-73-3']; matched_chebi_ids=['http://purl.obolibrary.org/obo/CHEBI_82420']; candidate_pubchem_cids=[8489, 184252]; selected_pubchem_cids=[8489]; 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 |
| 249,933 | rdkit_pre_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C6H4ClNO2"… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C6H4ClNO2"… | rdkit_pre_consensus from 'C1=CC(=CC(=C1)Cl)[N+](=O)[O-]'; added: monoisotopic_mass |
| 255,113 | chebi_altlabels | altLabel | [] | [{"@value":"3-chloronitrobenzene","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov:wasAttribute… | Added 6 ChEBI synonym(s) as altLabel from 1 linked ChEBI record(s) |
| 259,078 | consensus_match | altLabel | [{"@value":"3-chloronitrobenzene","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov:wasAttribute… | [{"@value":"3-chloronitrobenzene","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov:wasAttribute… | group_key=1-chloro-3-nitrobenzene||dimension=Environmental > media=Air > strata=Aircraft cruise height; cas=121-73-3; added Common Chemistry CAS names as altLabel: 1-Nitro-3-chlorobenzene, 3-Chloro-1-nitrobenzene, 3-Nitro-1-chlorobenzene, 3-Nitrophenyl chloride, Benzene, 1-chloro-3-nitro-, NSC 5502; object_uuid=fo-34a9e4c74b55edb5 |
| 259,079 | consensus_match | cas_match_labels | — | {"121-73-3":"exactMatch"} | group_key=1-chloro-3-nitrobenzene||dimension=Environmental > media=Air > strata=Aircraft cruise height; group_sources=['chebi', 'ec_inventory', 'pubchem']; cas_sources={'121-73-3': ['chebi', 'ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-34a9e4c74b55edb5: {'121-73-3': 'exactMatch'} |
| 275,068 | opsin_iupac | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C6H4ClNO2"… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C6H4ClNO2"… | opsin_iupac: set authoritative IUPAC name, SMILES, InChI from '1-chloro-3-nitrobenzene' |
| 281,556 | rdkit_post_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C6H4ClNO2"… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C6H4ClNO2"… | rdkit_post_consensus from 'O=[N+]([O-])c1cccc(Cl)c1'; confirmed: smiles_string, inchi2d_string, inchi2d_key_string, molecular_formula, molecular_mass, monoisotopic_mass |
| 288,436 | strip_catalogue_altlabels | altLabel | [{"@value":"3-chloronitrobenzene","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov:wasAttribute… | [{"@value":"3-chloronitrobenzene","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov:wasAttribute… | Removed 1 catalogue altLabel value(s): 'NSC 5502' (registry code) |
| 374,608 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/e574190c-95c9-… | associations resolved on the elementary layer |
| 389,370 | normalise_property_values | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C6H4ClNO2"… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C6H4ClNO2"… | typed the way the ontology types it |
| 396,488 | 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/20260820T1812399309960000/5840 | prefLabel | ef:agent/bootstrap_labels | ef:flow/e574190c-95c9-4191-b35f-d28c05b70105/v0 | ef:flow/e574190c-95c9-4191-b35f-d28c05b70105/v1 |
| ef:activity/change/20260820T1812399309960000/5841 | name | ef:agent/bootstrap_labels | ef:flow/e574190c-95c9-4191-b35f-d28c05b70105/v1 | ef:flow/e574190c-95c9-4191-b35f-d28c05b70105/v2 |
| ef:activity/change/20260820T1812399309960000/18760 | synonyms | ef:agent/bootstrap_labels | ef:flow/e574190c-95c9-4191-b35f-d28c05b70105/v2 | ef:flow/e574190c-95c9-4191-b35f-d28c05b70105/v3 |
| ef:activity/change/20260820T1812399309960000/187174 | context | ef:agent/default_context_mapping | ef:flow/e574190c-95c9-4191-b35f-d28c05b70105/v3 | ef:flow/e574190c-95c9-4191-b35f-d28c05b70105/v4 |
| ef:activity/change/20260820T1812399309960000/187175 | context_iri | ef:agent/default_context_mapping | ef:flow/e574190c-95c9-4191-b35f-d28c05b70105/v4 | ef:flow/e574190c-95c9-4191-b35f-d28c05b70105/v5 |
| ef:activity/change/20260820T1812399309960000/215289 | unit_iri | ef:agent/unit_normalization | ef:flow/e574190c-95c9-4191-b35f-d28c05b70105/v5 | ef:flow/e574190c-95c9-4191-b35f-d28c05b70105/v6 |
| ef:activity/change/20260820T1812399309960000/232799 | properties | ef:agent/enrich_references | ef:flow/e574190c-95c9-4191-b35f-d28c05b70105/v6 | ef:flow/e574190c-95c9-4191-b35f-d28c05b70105/v7 |
| ef:activity/change/20260820T1812399309960000/232800 | skos_definition | ef:agent/enrich_references | ef:flow/e574190c-95c9-4191-b35f-d28c05b70105/v7 | ef:flow/e574190c-95c9-4191-b35f-d28c05b70105/v8 |
| ef:activity/change/20260820T1812399309960000/232801 | references | ef:agent/enrich_references | ef:flow/e574190c-95c9-4191-b35f-d28c05b70105/v8 | ef:flow/e574190c-95c9-4191-b35f-d28c05b70105/v9 |
| ef:activity/change/20260820T1812399309960000/249933 | properties | ef:agent/rdkit_pre_consensus | ef:flow/e574190c-95c9-4191-b35f-d28c05b70105/v9 | ef:flow/e574190c-95c9-4191-b35f-d28c05b70105/v10 |
| ef:activity/change/20260820T1812399309960000/255113 | altLabel | ef:agent/chebi_altlabels | ef:flow/e574190c-95c9-4191-b35f-d28c05b70105/v10 | ef:flow/e574190c-95c9-4191-b35f-d28c05b70105/v11 |
| ef:activity/change/20260820T1812399309960000/259078 | altLabel | ef:agent/consensus_match | ef:flow/e574190c-95c9-4191-b35f-d28c05b70105/v11 | ef:flow/e574190c-95c9-4191-b35f-d28c05b70105/v12 |
| ef:activity/change/20260820T1812399309960000/259079 | cas_match_labels | ef:agent/consensus_match | ef:flow/e574190c-95c9-4191-b35f-d28c05b70105/v12 | ef:flow/e574190c-95c9-4191-b35f-d28c05b70105/v13 |
| ef:activity/change/20260820T1812399309960000/275068 | properties | ef:agent/opsin_iupac | ef:flow/e574190c-95c9-4191-b35f-d28c05b70105/v13 | ef:flow/e574190c-95c9-4191-b35f-d28c05b70105/v14 |
| ef:activity/change/20260820T1812399309960000/281556 | properties | ef:agent/rdkit_post_consensus | ef:flow/e574190c-95c9-4191-b35f-d28c05b70105/v14 | ef:flow/e574190c-95c9-4191-b35f-d28c05b70105/v15 |
| ef:activity/change/20260820T1812399309960000/288436 | altLabel | ef:agent/strip_catalogue_altlabels | ef:flow/e574190c-95c9-4191-b35f-d28c05b70105/v15 | ef:flow/e574190c-95c9-4191-b35f-d28c05b70105/v16 |
| ef:activity/change/20260820T1812399309960000/374608 | concept_associations | ef:agent/carry_associations_onto_flows | ef:flow/e574190c-95c9-4191-b35f-d28c05b70105/v16 | ef:flow/e574190c-95c9-4191-b35f-d28c05b70105/v17 |
| ef:activity/change/20260820T1812399309960000/389370 | properties | ef:agent/normalise_property_values | ef:flow/e574190c-95c9-4191-b35f-d28c05b70105/v17 | ef:flow/e574190c-95c9-4191-b35f-d28c05b70105/v18 |
| ef:activity/change/20260820T1812399309960000/396488 | types | ef:agent/link_flows_to_their_substance | ef:flow/e574190c-95c9-4191-b35f-d28c05b70105/v18 | ef:flow/e574190c-95c9-4191-b35f-d28c05b70105/v19 |