2-chloromethyl-3-chloropropene
Everything that changed this flow. Back to the flow
1f30fd4c-6556-11dd-ad8b-0800200c9a66
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 1 catalogue altLabel value(s): 'NSC 88138' (registry code) |
| cas_match_labels | 1 | consensus_match | group_key=2-chloromethyl-3-chloropropene||dimension=Environmental > media=Air > strata=Unknown; group_sources=['ec_inventory', 'pubchem']; cas_sources={'1871-57-4': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-5f83abed3c4989a5: {'1871-57-4': '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 (long-term) |
| 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 (long-term) |
| 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=['1871-57-4']; matched_chebi_ids=[]; candidate_pubchem_cids=[15859, 185363, 4407545, 6437823]; selected_pubchem_cids=[15859]; 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 |
|---|---|---|---|---|---|
| 7,598 | bootstrap_labels | prefLabel | — | [{"@value":"2-chloromethyl-3-chloropropene","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:w… | Bootstrapped prefLabel from legacy name field |
| 7,599 | bootstrap_labels | name | 2-chloromethyl-3-chloropropene | — | Purged legacy name field to enforce prefLabel usage |
| 7,600 | bootstrap_labels | synonyms | ["1,1-Bis(chloromethyl)ethylene","1,3-Dichloro-2-methylenepropane","1-Propene, 3-chloro-2-(chloromethyl)-","1-Propene,… | [] | Removed legacy synonyms field in favor of structured labels |
| 57,060 | default_context_mapping | context | — | {"dimension":"Environmental","media":"Water","water_body":"Long-term"} | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to water > Emissions to water, unspecified (long-term) |
| 57,061 | default_context_mapping | context_iri | — | https://vocab.brightway.one/flow-contexts/envi-wate-lote | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to water > Emissions to water, unspecified (long-term) |
| 215,876 | unit_normalization | unit_iri | — | https://vocab.brightway.one/units/unit/KiloGM | Unit IRI set from normalization of 'kg' |
| 234,455 | enrich_references | properties | {} | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C4H6Cl2"],… | Added ChEBI/PubChem properties (chebi_ids=0, pubchem_cids=1) |
| 234,456 | enrich_references | skos_definition | — | [] | Merged ChEBI/PubChem definitions into skos:definition |
| 234,457 | enrich_references | references | [] | [{"@id":"http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J5.193D","provenance":{"prov:wasGeneratedBy":"enrich_reference… | Added references with provenance; cas_numbers=['1871-57-4']; matched_chebi_ids=[]; candidate_pubchem_cids=[15859, 185363, 4407545, 6437823]; selected_pubchem_cids=[15859]; 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 |
| 250,409 | rdkit_pre_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C4H6Cl2"],… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C4H6Cl2"],… | rdkit_pre_consensus from 'C=C(CCl)CCl'; added: molecular_mass, monoisotopic_mass |
| 260,720 | consensus_match | altLabel | [] | [{"@value":"1,1-Bis(chloromethyl)ethene","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAt… | group_key=2-chloromethyl-3-chloropropene||dimension=Environmental > media=Air > strata=Unknown; cas=1871-57-4; added Common Chemistry CAS names as altLabel: 1,1-Bis(chloromethyl)ethene, 1,1-Bis(chloromethyl)ethylene, 1,3-Dichloro-2-methylenepropane, 1-Propene, 3-chloro-2-(chloromethyl)-, 2-(Chloromethyl)allyl chloride, 2-Chloromethyl-2-propenyl chloride, 2-Chloromethyl-3-chloro-1-propene, 2-Methylene-1,3-dichloropropane, 2-Methylenepropane-1,3-dichloride, 3-Chloro-2-(chloromethyl)-1-propene, 3-Chloro-2-(chloromethyl)propene, NSC 88138, Propene, 3-chloro-2-(chloromethyl)-; object_uuid=fo-5f83abed3c4989a5 |
| 260,721 | consensus_match | cas_match_labels | — | {"1871-57-4":"exactMatch"} | group_key=2-chloromethyl-3-chloropropene||dimension=Environmental > media=Air > strata=Unknown; group_sources=['ec_inventory', 'pubchem']; cas_sources={'1871-57-4': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-5f83abed3c4989a5: {'1871-57-4': 'exactMatch'} |
| 275,570 | opsin_iupac | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C4H6Cl2"],… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C4H6Cl2"],… | opsin_iupac: set authoritative IUPAC name, SMILES, InChI from '2-chloromethyl-3-chloropropene' |
| 282,093 | rdkit_post_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C4H6Cl2"],… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C4H6Cl2"],… | rdkit_post_consensus from 'C=C(CCl)CCl'; confirmed: smiles_string, inchi2d_string, inchi2d_key_string, molecular_formula, molecular_mass, monoisotopic_mass |
| 288,813 | strip_catalogue_altlabels | altLabel | [{"@value":"1,1-Bis(chloromethyl)ethene","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAt… | [{"@value":"1,1-Bis(chloromethyl)ethene","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAt… | Removed 1 catalogue altLabel value(s): 'NSC 88138' (registry code) |
| 309,550 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/1f30fd4c-6556-… | associations resolved on the elementary layer |
| 389,881 | normalise_property_values | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C4H6Cl2"],… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C4H6Cl2"],… | typed the way the ontology types it |
| 397,246 | 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/20260821T0609040591070000/7598 | prefLabel | ef:agent/bootstrap_labels | ef:flow/1f30fd4c-6556-11dd-ad8b-0800200c9a66/v0 | ef:flow/1f30fd4c-6556-11dd-ad8b-0800200c9a66/v1 |
| ef:activity/change/20260821T0609040591070000/7599 | name | ef:agent/bootstrap_labels | ef:flow/1f30fd4c-6556-11dd-ad8b-0800200c9a66/v1 | ef:flow/1f30fd4c-6556-11dd-ad8b-0800200c9a66/v2 |
| ef:activity/change/20260821T0609040591070000/7600 | synonyms | ef:agent/bootstrap_labels | ef:flow/1f30fd4c-6556-11dd-ad8b-0800200c9a66/v2 | ef:flow/1f30fd4c-6556-11dd-ad8b-0800200c9a66/v3 |
| ef:activity/change/20260821T0609040591070000/57060 | context | ef:agent/default_context_mapping | ef:flow/1f30fd4c-6556-11dd-ad8b-0800200c9a66/v3 | ef:flow/1f30fd4c-6556-11dd-ad8b-0800200c9a66/v4 |
| ef:activity/change/20260821T0609040591070000/57061 | context_iri | ef:agent/default_context_mapping | ef:flow/1f30fd4c-6556-11dd-ad8b-0800200c9a66/v4 | ef:flow/1f30fd4c-6556-11dd-ad8b-0800200c9a66/v5 |
| ef:activity/change/20260821T0609040591070000/215876 | unit_iri | ef:agent/unit_normalization | ef:flow/1f30fd4c-6556-11dd-ad8b-0800200c9a66/v5 | ef:flow/1f30fd4c-6556-11dd-ad8b-0800200c9a66/v6 |
| ef:activity/change/20260821T0609040591070000/234455 | properties | ef:agent/enrich_references | ef:flow/1f30fd4c-6556-11dd-ad8b-0800200c9a66/v6 | ef:flow/1f30fd4c-6556-11dd-ad8b-0800200c9a66/v7 |
| ef:activity/change/20260821T0609040591070000/234456 | skos_definition | ef:agent/enrich_references | ef:flow/1f30fd4c-6556-11dd-ad8b-0800200c9a66/v7 | ef:flow/1f30fd4c-6556-11dd-ad8b-0800200c9a66/v8 |
| ef:activity/change/20260821T0609040591070000/234457 | references | ef:agent/enrich_references | ef:flow/1f30fd4c-6556-11dd-ad8b-0800200c9a66/v8 | ef:flow/1f30fd4c-6556-11dd-ad8b-0800200c9a66/v9 |
| ef:activity/change/20260821T0609040591070000/250409 | properties | ef:agent/rdkit_pre_consensus | ef:flow/1f30fd4c-6556-11dd-ad8b-0800200c9a66/v9 | ef:flow/1f30fd4c-6556-11dd-ad8b-0800200c9a66/v10 |
| ef:activity/change/20260821T0609040591070000/260720 | altLabel | ef:agent/consensus_match | ef:flow/1f30fd4c-6556-11dd-ad8b-0800200c9a66/v10 | ef:flow/1f30fd4c-6556-11dd-ad8b-0800200c9a66/v11 |
| ef:activity/change/20260821T0609040591070000/260721 | cas_match_labels | ef:agent/consensus_match | ef:flow/1f30fd4c-6556-11dd-ad8b-0800200c9a66/v11 | ef:flow/1f30fd4c-6556-11dd-ad8b-0800200c9a66/v12 |
| ef:activity/change/20260821T0609040591070000/275570 | properties | ef:agent/opsin_iupac | ef:flow/1f30fd4c-6556-11dd-ad8b-0800200c9a66/v12 | ef:flow/1f30fd4c-6556-11dd-ad8b-0800200c9a66/v13 |
| ef:activity/change/20260821T0609040591070000/282093 | properties | ef:agent/rdkit_post_consensus | ef:flow/1f30fd4c-6556-11dd-ad8b-0800200c9a66/v13 | ef:flow/1f30fd4c-6556-11dd-ad8b-0800200c9a66/v14 |
| ef:activity/change/20260821T0609040591070000/288813 | altLabel | ef:agent/strip_catalogue_altlabels | ef:flow/1f30fd4c-6556-11dd-ad8b-0800200c9a66/v14 | ef:flow/1f30fd4c-6556-11dd-ad8b-0800200c9a66/v15 |
| ef:activity/change/20260821T0609040591070000/309550 | concept_associations | ef:agent/carry_associations_onto_flows | ef:flow/1f30fd4c-6556-11dd-ad8b-0800200c9a66/v15 | ef:flow/1f30fd4c-6556-11dd-ad8b-0800200c9a66/v16 |
| ef:activity/change/20260821T0609040591070000/389881 | properties | ef:agent/normalise_property_values | ef:flow/1f30fd4c-6556-11dd-ad8b-0800200c9a66/v16 | ef:flow/1f30fd4c-6556-11dd-ad8b-0800200c9a66/v17 |
| ef:activity/change/20260821T0609040591070000/397246 | types | ef:agent/link_flows_to_their_substance | ef:flow/1f30fd4c-6556-11dd-ad8b-0800200c9a66/v17 | ef:flow/1f30fd4c-6556-11dd-ad8b-0800200c9a66/v18 |