2-chlorobutane
Everything that changed this flow. Back to the flow
3b4a83be-20aa-4101-968e-d32df2817e88
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 | chebi_altlabels, consensus_match | group_key=2-chlorobutane||dimension=Environmental > media=Ground > geography=Agricultural; cas=78-86-4; added Common Chemistry CAS names as altLabel: (±)-2-Chlorobutane; object_uuid=fo-f879fa4e36a639c3 |
| cas_match_labels | 1 | consensus_match | group_key=2-chlorobutane||dimension=Environmental > media=Ground > geography=Agricultural; group_sources=['chebi', 'ec_inventory', 'pubchem']; cas_sources={'78-86-4': ['chebi', 'ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-f879fa4e36a639c3: {'78-86-4': '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 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=['78-86-4']; matched_chebi_ids=['http://purl.obolibrary.org/obo/CHEBI_166855']; candidate_pubchem_cids=[6563, 278822]; selected_pubchem_cids=[6563]; 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 |
|---|---|---|---|---|---|
| 9,796 | bootstrap_labels | prefLabel | — | [{"@value":"2-chlorobutane","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:wasAttributedTo":… | Bootstrapped prefLabel from legacy name field |
| 9,797 | bootstrap_labels | name | 2-chlorobutane | — | Purged legacy name field to enforce prefLabel usage |
| 9,798 | bootstrap_labels | synonyms | ["organic","2-chlorobutane"] | [] | Removed legacy synonyms field in favor of structured labels |
| 75,826 | 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 |
| 75,827 | 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 |
| 216,594 | unit_normalization | unit_iri | — | https://vocab.brightway.one/units/unit/KiloGM | Unit IRI set from normalization of 'kg' |
| 236,539 | enrich_references | properties | {} | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C4H9Cl"],"… | Added ChEBI/PubChem properties (chebi_ids=1, pubchem_cids=1) |
| 236,540 | enrich_references | skos_definition | — | [{"@value":"A chloroalkane that is butane which carries a chloro group at position 2.","@language":"en","provenance":{"… | Merged ChEBI/PubChem definitions into skos:definition |
| 236,541 | enrich_references | references | [] | [{"@id":"http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J1.485K","provenance":{"prov:wasGeneratedBy":"enrich_reference… | Added references with provenance; cas_numbers=['78-86-4']; matched_chebi_ids=['http://purl.obolibrary.org/obo/CHEBI_166855']; candidate_pubchem_cids=[6563, 278822]; selected_pubchem_cids=[6563]; 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 |
| 251,008 | rdkit_pre_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C4H9Cl"],"… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C4H9Cl"],"… | rdkit_pre_consensus from 'CCC(C)Cl'; added: monoisotopic_mass |
| 255,781 | chebi_altlabels | altLabel | [] | [{"@value":"1-chloro-1-methylpropane","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov:wasAttri… | Added 5 ChEBI synonym(s) as altLabel from 1 linked ChEBI record(s) |
| 260,712 | consensus_match | altLabel | [{"@value":"1-chloro-1-methylpropane","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov:wasAttri… | [{"@value":"1-chloro-1-methylpropane","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov:wasAttri… | group_key=2-chlorobutane||dimension=Environmental > media=Ground > geography=Agricultural; cas=78-86-4; added Common Chemistry CAS names as altLabel: (±)-2-Chlorobutane; object_uuid=fo-f879fa4e36a639c3 |
| 260,713 | consensus_match | cas_match_labels | — | {"78-86-4":"exactMatch"} | group_key=2-chlorobutane||dimension=Environmental > media=Ground > geography=Agricultural; group_sources=['chebi', 'ec_inventory', 'pubchem']; cas_sources={'78-86-4': ['chebi', 'ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-f879fa4e36a639c3: {'78-86-4': 'exactMatch'} |
| 276,194 | opsin_iupac | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C4H9Cl"],"… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C4H9Cl"],"… | opsin_iupac: set authoritative IUPAC name, SMILES, InChI from '2-chlorobutane' |
| 282,777 | rdkit_post_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C4H9Cl"],"… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C4H9Cl"],"… | rdkit_post_consensus from 'CCC(C)Cl'; confirmed: smiles_string, inchi2d_string, inchi2d_key_string, molecular_formula, molecular_mass, monoisotopic_mass |
| 318,928 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/3b4a83be-20aa-… | associations resolved on the elementary layer |
| 390,539 | normalise_property_values | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C4H9Cl"],"… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C4H9Cl"],"… | typed the way the ontology types it |
| 398,189 | 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/20260821T1302361922970000/9796 | prefLabel | ef:agent/bootstrap_labels | ef:flow/3b4a83be-20aa-4101-968e-d32df2817e88/v0 | ef:flow/3b4a83be-20aa-4101-968e-d32df2817e88/v1 |
| ef:activity/change/20260821T1302361922970000/9797 | name | ef:agent/bootstrap_labels | ef:flow/3b4a83be-20aa-4101-968e-d32df2817e88/v1 | ef:flow/3b4a83be-20aa-4101-968e-d32df2817e88/v2 |
| ef:activity/change/20260821T1302361922970000/9798 | synonyms | ef:agent/bootstrap_labels | ef:flow/3b4a83be-20aa-4101-968e-d32df2817e88/v2 | ef:flow/3b4a83be-20aa-4101-968e-d32df2817e88/v3 |
| ef:activity/change/20260821T1302361922970000/75826 | context | ef:agent/default_context_mapping | ef:flow/3b4a83be-20aa-4101-968e-d32df2817e88/v3 | ef:flow/3b4a83be-20aa-4101-968e-d32df2817e88/v4 |
| ef:activity/change/20260821T1302361922970000/75827 | context_iri | ef:agent/default_context_mapping | ef:flow/3b4a83be-20aa-4101-968e-d32df2817e88/v4 | ef:flow/3b4a83be-20aa-4101-968e-d32df2817e88/v5 |
| ef:activity/change/20260821T1302361922970000/216594 | unit_iri | ef:agent/unit_normalization | ef:flow/3b4a83be-20aa-4101-968e-d32df2817e88/v5 | ef:flow/3b4a83be-20aa-4101-968e-d32df2817e88/v6 |
| ef:activity/change/20260821T1302361922970000/236539 | properties | ef:agent/enrich_references | ef:flow/3b4a83be-20aa-4101-968e-d32df2817e88/v6 | ef:flow/3b4a83be-20aa-4101-968e-d32df2817e88/v7 |
| ef:activity/change/20260821T1302361922970000/236540 | skos_definition | ef:agent/enrich_references | ef:flow/3b4a83be-20aa-4101-968e-d32df2817e88/v7 | ef:flow/3b4a83be-20aa-4101-968e-d32df2817e88/v8 |
| ef:activity/change/20260821T1302361922970000/236541 | references | ef:agent/enrich_references | ef:flow/3b4a83be-20aa-4101-968e-d32df2817e88/v8 | ef:flow/3b4a83be-20aa-4101-968e-d32df2817e88/v9 |
| ef:activity/change/20260821T1302361922970000/251008 | properties | ef:agent/rdkit_pre_consensus | ef:flow/3b4a83be-20aa-4101-968e-d32df2817e88/v9 | ef:flow/3b4a83be-20aa-4101-968e-d32df2817e88/v10 |
| ef:activity/change/20260821T1302361922970000/255781 | altLabel | ef:agent/chebi_altlabels | ef:flow/3b4a83be-20aa-4101-968e-d32df2817e88/v10 | ef:flow/3b4a83be-20aa-4101-968e-d32df2817e88/v11 |
| ef:activity/change/20260821T1302361922970000/260712 | altLabel | ef:agent/consensus_match | ef:flow/3b4a83be-20aa-4101-968e-d32df2817e88/v11 | ef:flow/3b4a83be-20aa-4101-968e-d32df2817e88/v12 |
| ef:activity/change/20260821T1302361922970000/260713 | cas_match_labels | ef:agent/consensus_match | ef:flow/3b4a83be-20aa-4101-968e-d32df2817e88/v12 | ef:flow/3b4a83be-20aa-4101-968e-d32df2817e88/v13 |
| ef:activity/change/20260821T1302361922970000/276194 | properties | ef:agent/opsin_iupac | ef:flow/3b4a83be-20aa-4101-968e-d32df2817e88/v13 | ef:flow/3b4a83be-20aa-4101-968e-d32df2817e88/v14 |
| ef:activity/change/20260821T1302361922970000/282777 | properties | ef:agent/rdkit_post_consensus | ef:flow/3b4a83be-20aa-4101-968e-d32df2817e88/v14 | ef:flow/3b4a83be-20aa-4101-968e-d32df2817e88/v15 |
| ef:activity/change/20260821T1302361922970000/318928 | concept_associations | ef:agent/carry_associations_onto_flows | ef:flow/3b4a83be-20aa-4101-968e-d32df2817e88/v15 | ef:flow/3b4a83be-20aa-4101-968e-d32df2817e88/v16 |
| ef:activity/change/20260821T1302361922970000/390539 | properties | ef:agent/normalise_property_values | ef:flow/3b4a83be-20aa-4101-968e-d32df2817e88/v16 | ef:flow/3b4a83be-20aa-4101-968e-d32df2817e88/v17 |
| ef:activity/change/20260821T1302361922970000/398189 | types | ef:agent/link_flows_to_their_substance | ef:flow/3b4a83be-20aa-4101-968e-d32df2817e88/v17 | ef:flow/3b4a83be-20aa-4101-968e-d32df2817e88/v18 |