Methyl (2e)-2-cyano-3-(2,2-difluoro-1,3-benzodioxol-4-yl)prop-2-enoate
Everything that changed this flow. Back to the flow
75142be1-fc9f-4942-a637-dbf7c811116a
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 |
| 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=methyl(2e)-2-cyano-3-(2,2-difluoro-1,3-benzodioxol-4-yl)prop-2-enoate||dimension=Environmental > media=Air > indoor=Unknown; cas=1333488-95-1; added Common Chemistry CAS names as altLabel: 2-Propenoic acid, 2-cyano-3-(2,2-difluoro-1,3-benzodioxol-4-yl)-, methyl ester, Methyl 2-cyano-3-(2,2-difluoro-1,3-benzodioxol-4-yl)-2-propenoate; object_uuid=fo-d570e9d73d7f12a7 |
| cas_match_labels | 1 | consensus_match | group_key=methyl(2e)-2-cyano-3-(2,2-difluoro-1,3-benzodioxol-4-yl)prop-2-enoate||dimension=Environmental > media=Air > indoor=Unknown; group_sources=[]; cas_sources={'1333488-95-1': []}; assigned CAS labels from group consensus; object_uuid=fo-d570e9d73d7f12a7: {'1333488-95-1': '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 |
| references | 1 | enrich_references | Added references with provenance; cas_numbers=['1333488-95-1']; matched_chebi_ids=[]; candidate_pubchem_cids=[138402783]; selected_pubchem_cids=[]; 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 |
|---|---|---|---|---|---|
| 918 | bootstrap_labels | prefLabel | — | [{"@value":"methyl (2e)-2-cyano-3-(2,2-difluoro-1,3-benzodioxol-4-yl)prop-2-enoate","@language":"en","source":{"prov:wa… | Bootstrapped prefLabel from legacy name field |
| 919 | bootstrap_labels | name | methyl (2e)-2-cyano-3-(2,2-difluoro-1,3-benzodioxol-4-yl)prop-2-enoate | — | Purged legacy name field to enforce prefLabel usage |
| 920 | bootstrap_labels | synonyms | ["organic","dfester","df-cyanzimt-sre-me-est","dfe"] | [] | Removed legacy synonyms field in favor of structured labels |
| 119,494 | 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) |
| 119,495 | 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) |
| 213,647 | unit_normalization | unit_iri | — | https://vocab.brightway.one/units/unit/KiloGM | Unit IRI set from normalization of 'kg' |
| 221,311 | normalize_name_case | prefLabel | [{"@value":"methyl (2e)-2-cyano-3-(2,2-difluoro-1,3-benzodioxol-4-yl)prop-2-enoate","@language":"en","source":{"prov:wa… | [{"@value":"Methyl (2e)-2-cyano-3-(2,2-difluoro-1,3-benzodioxol-4-yl)prop-2-enoate","@language":"en","source":{"prov:wa… | Title-cased words without internal capitals (preserved words with uppercase letters beyond the first character) |
| 228,057 | enrich_references | properties | {} | {"https://w3id.org/chemrof/inchi2d_key_string":{"@id":"https://w3id.org/chemrof/inchi2d_key_string","@value":["CDKRRBYJ… | Added ChEBI/PubChem properties (chebi_ids=0, pubchem_cids=0, commonchemistry_cas=['1333488-95-1']) |
| 228,058 | enrich_references | skos_definition | — | [] | Merged ChEBI/PubChem definitions into skos:definition |
| 228,059 | enrich_references | references | [] | [{"@id":"https://commonchemistry.cas.org/detail?cas_rn=1333488-95-1","provenance":{"prov:wasGeneratedBy":"enrich_refere… | Added references with provenance; cas_numbers=['1333488-95-1']; matched_chebi_ids=[]; candidate_pubchem_cids=[138402783]; selected_pubchem_cids=[]; 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 |
| 248,571 | rdkit_pre_consensus | properties | {"https://w3id.org/chemrof/inchi2d_key_string":{"@id":"https://w3id.org/chemrof/inchi2d_key_string","@value":["CDKRRBYJ… | {"https://w3id.org/chemrof/inchi2d_key_string":{"@id":"https://w3id.org/chemrof/inchi2d_key_string","@value":["CDKRRBYJ… | rdkit_pre_consensus from 'InChI=1S/C12H7F2NO4/c1-17-11(16)8(6-15)5-7-3-2-4-9-10(7)19-12(13,14)18-9/h2-5H,1H3'; added: smiles_string, molecular_mass, monoisotopic_mass |
| 268,708 | consensus_match | altLabel | [] | [{"@value":"2-Propenoic acid, 2-cyano-3-(2,2-difluoro-1,3-benzodioxol-4-yl)-, methyl ester","@language":"en","source":{… | group_key=methyl(2e)-2-cyano-3-(2,2-difluoro-1,3-benzodioxol-4-yl)prop-2-enoate||dimension=Environmental > media=Air > indoor=Unknown; cas=1333488-95-1; added Common Chemistry CAS names as altLabel: 2-Propenoic acid, 2-cyano-3-(2,2-difluoro-1,3-benzodioxol-4-yl)-, methyl ester, Methyl 2-cyano-3-(2,2-difluoro-1,3-benzodioxol-4-yl)-2-propenoate; object_uuid=fo-d570e9d73d7f12a7 |
| 268,709 | consensus_match | cas_match_labels | — | {"1333488-95-1":"exactMatch"} | group_key=methyl(2e)-2-cyano-3-(2,2-difluoro-1,3-benzodioxol-4-yl)prop-2-enoate||dimension=Environmental > media=Air > indoor=Unknown; group_sources=[]; cas_sources={'1333488-95-1': []}; assigned CAS labels from group consensus; object_uuid=fo-d570e9d73d7f12a7: {'1333488-95-1': 'exactMatch'} |
| 273,710 | opsin_iupac | properties | {"https://w3id.org/chemrof/inchi2d_key_string":{"@id":"https://w3id.org/chemrof/inchi2d_key_string","@value":["CDKRRBYJ… | {"https://w3id.org/chemrof/inchi2d_key_string":{"@id":"https://w3id.org/chemrof/inchi2d_key_string","@value":["CDKRRBYJ… | opsin_iupac: set authoritative IUPAC name, SMILES, InChI from '2-Propenoic acid, 2-cyano-3-(2,2-difluoro-1,3-benzodioxol-4-yl)-, methyl ester' |
| 280,082 | rdkit_post_consensus | properties | {"https://w3id.org/chemrof/inchi2d_key_string":{"@id":"https://w3id.org/chemrof/inchi2d_key_string","@value":["CDKRRBYJ… | {"https://w3id.org/chemrof/inchi2d_key_string":{"@id":"https://w3id.org/chemrof/inchi2d_key_string","@value":["CDKRRBYJ… | rdkit_post_consensus from 'COC(=O)C(C#N)=Cc1cccc2c1OC(F)(F)O2'; confirmed: smiles_string, inchi2d_string, inchi2d_key_string, molecular_formula, molecular_mass, monoisotopic_mass |
| 340,765 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/75142be1-fc9f-… | associations resolved on the elementary layer |
| 387,991 | normalise_property_values | properties | {"https://w3id.org/chemrof/inchi2d_key_string":{"@id":"https://w3id.org/chemrof/inchi2d_key_string","@value":["CDKRRBYJ… | {"https://w3id.org/chemrof/inchi2d_key_string":{"@id":"https://w3id.org/chemrof/inchi2d_key_string","@value":["CDKRRBYJ… | typed the way the ontology types it |
| 394,553 | 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/20260820T1416470405690000/918 | prefLabel | ef:agent/bootstrap_labels | ef:flow/75142be1-fc9f-4942-a637-dbf7c811116a/v0 | ef:flow/75142be1-fc9f-4942-a637-dbf7c811116a/v1 |
| ef:activity/change/20260820T1416470405690000/919 | name | ef:agent/bootstrap_labels | ef:flow/75142be1-fc9f-4942-a637-dbf7c811116a/v1 | ef:flow/75142be1-fc9f-4942-a637-dbf7c811116a/v2 |
| ef:activity/change/20260820T1416470405690000/920 | synonyms | ef:agent/bootstrap_labels | ef:flow/75142be1-fc9f-4942-a637-dbf7c811116a/v2 | ef:flow/75142be1-fc9f-4942-a637-dbf7c811116a/v3 |
| ef:activity/change/20260820T1416470405690000/119494 | context | ef:agent/default_context_mapping | ef:flow/75142be1-fc9f-4942-a637-dbf7c811116a/v3 | ef:flow/75142be1-fc9f-4942-a637-dbf7c811116a/v4 |
| ef:activity/change/20260820T1416470405690000/119495 | context_iri | ef:agent/default_context_mapping | ef:flow/75142be1-fc9f-4942-a637-dbf7c811116a/v4 | ef:flow/75142be1-fc9f-4942-a637-dbf7c811116a/v5 |
| ef:activity/change/20260820T1416470405690000/213647 | unit_iri | ef:agent/unit_normalization | ef:flow/75142be1-fc9f-4942-a637-dbf7c811116a/v5 | ef:flow/75142be1-fc9f-4942-a637-dbf7c811116a/v6 |
| ef:activity/change/20260820T1416470405690000/221311 | prefLabel | ef:agent/normalize_name_case | ef:flow/75142be1-fc9f-4942-a637-dbf7c811116a/v6 | ef:flow/75142be1-fc9f-4942-a637-dbf7c811116a/v7 |
| ef:activity/change/20260820T1416470405690000/228057 | properties | ef:agent/enrich_references | ef:flow/75142be1-fc9f-4942-a637-dbf7c811116a/v7 | ef:flow/75142be1-fc9f-4942-a637-dbf7c811116a/v8 |
| ef:activity/change/20260820T1416470405690000/228058 | skos_definition | ef:agent/enrich_references | ef:flow/75142be1-fc9f-4942-a637-dbf7c811116a/v8 | ef:flow/75142be1-fc9f-4942-a637-dbf7c811116a/v9 |
| ef:activity/change/20260820T1416470405690000/228059 | references | ef:agent/enrich_references | ef:flow/75142be1-fc9f-4942-a637-dbf7c811116a/v9 | ef:flow/75142be1-fc9f-4942-a637-dbf7c811116a/v10 |
| ef:activity/change/20260820T1416470405690000/248571 | properties | ef:agent/rdkit_pre_consensus | ef:flow/75142be1-fc9f-4942-a637-dbf7c811116a/v10 | ef:flow/75142be1-fc9f-4942-a637-dbf7c811116a/v11 |
| ef:activity/change/20260820T1416470405690000/268708 | altLabel | ef:agent/consensus_match | ef:flow/75142be1-fc9f-4942-a637-dbf7c811116a/v11 | ef:flow/75142be1-fc9f-4942-a637-dbf7c811116a/v12 |
| ef:activity/change/20260820T1416470405690000/268709 | cas_match_labels | ef:agent/consensus_match | ef:flow/75142be1-fc9f-4942-a637-dbf7c811116a/v12 | ef:flow/75142be1-fc9f-4942-a637-dbf7c811116a/v13 |
| ef:activity/change/20260820T1416470405690000/273710 | properties | ef:agent/opsin_iupac | ef:flow/75142be1-fc9f-4942-a637-dbf7c811116a/v13 | ef:flow/75142be1-fc9f-4942-a637-dbf7c811116a/v14 |
| ef:activity/change/20260820T1416470405690000/280082 | properties | ef:agent/rdkit_post_consensus | ef:flow/75142be1-fc9f-4942-a637-dbf7c811116a/v14 | ef:flow/75142be1-fc9f-4942-a637-dbf7c811116a/v15 |
| ef:activity/change/20260820T1416470405690000/340765 | concept_associations | ef:agent/carry_associations_onto_flows | ef:flow/75142be1-fc9f-4942-a637-dbf7c811116a/v15 | ef:flow/75142be1-fc9f-4942-a637-dbf7c811116a/v16 |
| ef:activity/change/20260820T1416470405690000/387991 | properties | ef:agent/normalise_property_values | ef:flow/75142be1-fc9f-4942-a637-dbf7c811116a/v16 | ef:flow/75142be1-fc9f-4942-a637-dbf7c811116a/v17 |
| ef:activity/change/20260820T1416470405690000/394553 | types | ef:agent/link_flows_to_their_substance | ef:flow/75142be1-fc9f-4942-a637-dbf7c811116a/v17 | ef:flow/75142be1-fc9f-4942-a637-dbf7c811116a/v18 |