2-methyl-3-methoxy Benzoyl Chloride
Everything that changed this flow. Back to the flow
73778834-7ce6-487b-8ce3-222fa2e7153c
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 |
| prefLabel | 2 | bootstrap_labels, normalize_name_case | Title-cased words without internal capitals (preserved words with uppercase letters beyond the first character) |
| cas_match_labels | 1 | consensus_match | group_key=2-methyl-3-methoxybenzoylchloride||dimension=Environmental > media=Ground > geography=Agricultural; group_sources=[]; cas_sources={'24487-91-0': []}; assigned CAS labels from group consensus; object_uuid=fo-18a0a59d9bb5be1c: {'24487-91-0': '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=['24487-91-0']; matched_chebi_ids=[]; candidate_pubchem_cids=[14719554]; selected_pubchem_cids=[14719554]; 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 |
|---|---|---|---|---|---|
| 14,671 | bootstrap_labels | prefLabel | — | [{"@value":"2-methyl-3-methoxy benzoyl chloride","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","p… | Bootstrapped prefLabel from legacy name field |
| 14,672 | bootstrap_labels | name | 2-methyl-3-methoxy benzoyl chloride | — | Purged legacy name field to enforce prefLabel usage |
| 14,673 | bootstrap_labels | synonyms | ["organic","mmbc"] | [] | Removed legacy synonyms field in favor of structured labels |
| 118,548 | 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) |
| 118,549 | 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) |
| 218,183 | unit_normalization | unit_iri | — | https://vocab.brightway.one/units/unit/KiloGM | Unit IRI set from normalization of 'kg' |
| 224,487 | normalize_name_case | prefLabel | [{"@value":"2-methyl-3-methoxy benzoyl chloride","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","p… | [{"@value":"2-methyl-3-methoxy Benzoyl Chloride","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","p… | Title-cased words without internal capitals (preserved words with uppercase letters beyond the first character) |
| 241,066 | enrich_references | properties | {} | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C9H9ClO2"]… | Added ChEBI/PubChem properties (chebi_ids=0, pubchem_cids=1) |
| 241,067 | enrich_references | skos_definition | — | [] | Merged ChEBI/PubChem definitions into skos:definition |
| 241,068 | enrich_references | references | [] | [{"@id":"http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J3.782.116K","provenance":{"prov:wasGeneratedBy":"enrich_refer… | Added references with provenance; cas_numbers=['24487-91-0']; matched_chebi_ids=[]; candidate_pubchem_cids=[14719554]; selected_pubchem_cids=[14719554]; 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 |
| 252,320 | rdkit_pre_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C9H9ClO2"]… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C9H9ClO2"]… | rdkit_pre_consensus from 'CC1=C(C=CC=C1OC)C(=O)Cl'; added: molecular_mass, monoisotopic_mass |
| 261,083 | consensus_match | altLabel | [] | [{"@value":"2-Methyl-3-methoxybenzoyl chloride","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","pro… | group_key=2-methyl-3-methoxybenzoylchloride||dimension=Environmental > media=Ground > geography=Agricultural; cas=24487-91-0; added Common Chemistry CAS names as altLabel: 2-Methyl-3-methoxybenzoyl chloride, 2-Methyl-<em>m</em>-anisoyl chloride, 3-Methoxy-2-methylbenzoyl chloride, <em>m</em>-Anisoyl chloride, 2-methyl-, Benzoyl chloride, 3-methoxy-2-methyl-; object_uuid=fo-18a0a59d9bb5be1c |
| 261,084 | consensus_match | cas_match_labels | — | {"24487-91-0":"exactMatch"} | group_key=2-methyl-3-methoxybenzoylchloride||dimension=Environmental > media=Ground > geography=Agricultural; group_sources=[]; cas_sources={'24487-91-0': []}; assigned CAS labels from group consensus; object_uuid=fo-18a0a59d9bb5be1c: {'24487-91-0': 'exactMatch'} |
| 277,530 | opsin_iupac | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C9H9ClO2"]… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C9H9ClO2"]… | opsin_iupac: set authoritative IUPAC name, SMILES, InChI from '2-methyl-3-methoxy Benzoyl Chloride' |
| 284,219 | rdkit_post_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C9H9ClO2"]… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C9H9ClO2"]… | rdkit_post_consensus from 'COc1cccc(C(=O)Cl)c1C'; confirmed: smiles_string, inchi2d_string, inchi2d_key_string, molecular_formula, molecular_mass, monoisotopic_mass |
| 292,792 | dedupe_altlabels | altLabel | [{"@value":"2-Methyl-3-methoxybenzoyl chloride","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","pro… | [{"@value":"2-Methyl-3-methoxybenzoyl chloride","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","pro… | Deduplicated altLabel values and removed entries matching prefLabel |
| 340,292 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/73778834-7ce6-… | associations resolved on the elementary layer |
| 391,887 | normalise_property_values | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C9H9ClO2"]… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C9H9ClO2"]… | typed the way the ontology types it |
| 400,108 | 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/20260820T0738569779880000/14671 | prefLabel | ef:agent/bootstrap_labels | ef:flow/73778834-7ce6-487b-8ce3-222fa2e7153c/v0 | ef:flow/73778834-7ce6-487b-8ce3-222fa2e7153c/v1 |
| ef:activity/change/20260820T0738569779880000/14672 | name | ef:agent/bootstrap_labels | ef:flow/73778834-7ce6-487b-8ce3-222fa2e7153c/v1 | ef:flow/73778834-7ce6-487b-8ce3-222fa2e7153c/v2 |
| ef:activity/change/20260820T0738569779880000/14673 | synonyms | ef:agent/bootstrap_labels | ef:flow/73778834-7ce6-487b-8ce3-222fa2e7153c/v2 | ef:flow/73778834-7ce6-487b-8ce3-222fa2e7153c/v3 |
| ef:activity/change/20260820T0738569779880000/118548 | context | ef:agent/default_context_mapping | ef:flow/73778834-7ce6-487b-8ce3-222fa2e7153c/v3 | ef:flow/73778834-7ce6-487b-8ce3-222fa2e7153c/v4 |
| ef:activity/change/20260820T0738569779880000/118549 | context_iri | ef:agent/default_context_mapping | ef:flow/73778834-7ce6-487b-8ce3-222fa2e7153c/v4 | ef:flow/73778834-7ce6-487b-8ce3-222fa2e7153c/v5 |
| ef:activity/change/20260820T0738569779880000/218183 | unit_iri | ef:agent/unit_normalization | ef:flow/73778834-7ce6-487b-8ce3-222fa2e7153c/v5 | ef:flow/73778834-7ce6-487b-8ce3-222fa2e7153c/v6 |
| ef:activity/change/20260820T0738569779880000/224487 | prefLabel | ef:agent/normalize_name_case | ef:flow/73778834-7ce6-487b-8ce3-222fa2e7153c/v6 | ef:flow/73778834-7ce6-487b-8ce3-222fa2e7153c/v7 |
| ef:activity/change/20260820T0738569779880000/241066 | properties | ef:agent/enrich_references | ef:flow/73778834-7ce6-487b-8ce3-222fa2e7153c/v7 | ef:flow/73778834-7ce6-487b-8ce3-222fa2e7153c/v8 |
| ef:activity/change/20260820T0738569779880000/241067 | skos_definition | ef:agent/enrich_references | ef:flow/73778834-7ce6-487b-8ce3-222fa2e7153c/v8 | ef:flow/73778834-7ce6-487b-8ce3-222fa2e7153c/v9 |
| ef:activity/change/20260820T0738569779880000/241068 | references | ef:agent/enrich_references | ef:flow/73778834-7ce6-487b-8ce3-222fa2e7153c/v9 | ef:flow/73778834-7ce6-487b-8ce3-222fa2e7153c/v10 |
| ef:activity/change/20260820T0738569779880000/252320 | properties | ef:agent/rdkit_pre_consensus | ef:flow/73778834-7ce6-487b-8ce3-222fa2e7153c/v10 | ef:flow/73778834-7ce6-487b-8ce3-222fa2e7153c/v11 |
| ef:activity/change/20260820T0738569779880000/261083 | altLabel | ef:agent/consensus_match | ef:flow/73778834-7ce6-487b-8ce3-222fa2e7153c/v11 | ef:flow/73778834-7ce6-487b-8ce3-222fa2e7153c/v12 |
| ef:activity/change/20260820T0738569779880000/261084 | cas_match_labels | ef:agent/consensus_match | ef:flow/73778834-7ce6-487b-8ce3-222fa2e7153c/v12 | ef:flow/73778834-7ce6-487b-8ce3-222fa2e7153c/v13 |
| ef:activity/change/20260820T0738569779880000/277530 | properties | ef:agent/opsin_iupac | ef:flow/73778834-7ce6-487b-8ce3-222fa2e7153c/v13 | ef:flow/73778834-7ce6-487b-8ce3-222fa2e7153c/v14 |
| ef:activity/change/20260820T0738569779880000/284219 | properties | ef:agent/rdkit_post_consensus | ef:flow/73778834-7ce6-487b-8ce3-222fa2e7153c/v14 | ef:flow/73778834-7ce6-487b-8ce3-222fa2e7153c/v15 |
| ef:activity/change/20260820T0738569779880000/292792 | altLabel | ef:agent/dedupe_altlabels | ef:flow/73778834-7ce6-487b-8ce3-222fa2e7153c/v15 | ef:flow/73778834-7ce6-487b-8ce3-222fa2e7153c/v16 |
| ef:activity/change/20260820T0738569779880000/340292 | concept_associations | ef:agent/carry_associations_onto_flows | ef:flow/73778834-7ce6-487b-8ce3-222fa2e7153c/v16 | ef:flow/73778834-7ce6-487b-8ce3-222fa2e7153c/v17 |
| ef:activity/change/20260820T0738569779880000/391887 | properties | ef:agent/normalise_property_values | ef:flow/73778834-7ce6-487b-8ce3-222fa2e7153c/v17 | ef:flow/73778834-7ce6-487b-8ce3-222fa2e7153c/v18 |
| ef:activity/change/20260820T0738569779880000/400108 | types | ef:agent/link_flows_to_their_substance | ef:flow/73778834-7ce6-487b-8ce3-222fa2e7153c/v18 | ef:flow/73778834-7ce6-487b-8ce3-222fa2e7153c/v19 |