Methanesulphonyl Chloride
Everything that changed this flow. Back to the flow
47d21010-5420-475e-9506-f248073adcfd
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 15039' (registry code) |
| 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=methanesulphonylchloride||dimension=Environmental > media=Water > water_body=Unknown; group_sources=['ec_inventory', 'pubchem']; cas_sources={'124-63-0': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-3ea3520af8ed8a63: {'124-63-0': '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 air > Emissions to urban air close to ground |
| context_iri | 1 | default_context_mapping | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to air > Emissions to urban air close to ground |
| name | 1 | bootstrap_labels | Purged legacy name field to enforce prefLabel usage |
| references | 1 | enrich_references | Added references with provenance; cas_numbers=['124-63-0']; matched_chebi_ids=[]; candidate_pubchem_cids=[31297, 18913464]; selected_pubchem_cids=[31297]; 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 |
|---|---|---|---|---|---|
| 19,247 | bootstrap_labels | prefLabel | — | [{"@value":"methanesulphonyl chloride","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:wasAtt… | Bootstrapped prefLabel from legacy name field |
| 19,248 | bootstrap_labels | name | methanesulphonyl chloride | — | Purged legacy name field to enforce prefLabel usage |
| 19,249 | bootstrap_labels | synonyms | ["AB1003363","AC1L1LCT","AC1Q4GSI","AKOS000269070","Chloro methyl sulfone","Chloromethyl sulfone","FT-0082071","METHYLS… | [] | Removed legacy synonyms field in favor of structured labels |
| 84,022 | default_context_mapping | context | — | {"dimension":"Environmental","media":"Air","strata":"Ground level","population_density":"Urban (>1000 people/square mil… | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to air > Emissions to urban air close to ground |
| 84,023 | default_context_mapping | context_iri | — | https://vocab.brightway.one/flow-contexts/envi-air-grle-ur10pesq | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to air > Emissions to urban air close to ground |
| 219,610 | unit_normalization | unit_iri | — | https://vocab.brightway.one/units/unit/KiloGM | Unit IRI set from normalization of 'kg' |
| 225,471 | normalize_name_case | prefLabel | [{"@value":"methanesulphonyl chloride","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:wasAtt… | [{"@value":"Methanesulphonyl Chloride","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:wasAtt… | Title-cased words without internal capitals (preserved words with uppercase letters beyond the first character) |
| 245,087 | enrich_references | properties | {} | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["CH3ClO2S"]… | Added ChEBI/PubChem properties (chebi_ids=0, pubchem_cids=1) |
| 245,088 | enrich_references | skos_definition | — | [] | Merged ChEBI/PubChem definitions into skos:definition |
| 245,089 | enrich_references | references | [] | [{"@id":"http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J2.507K","provenance":{"prov:wasGeneratedBy":"enrich_reference… | Added references with provenance; cas_numbers=['124-63-0']; matched_chebi_ids=[]; candidate_pubchem_cids=[31297, 18913464]; selected_pubchem_cids=[31297]; 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 |
| 253,475 | rdkit_pre_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["CH3ClO2S"]… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["CH3ClO2S"]… | rdkit_pre_consensus from 'CS(=O)(=O)Cl'; added: molecular_mass, monoisotopic_mass |
| 268,646 | consensus_match | altLabel | [] | [{"@value":"Chloro methyl sulfone","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttribut… | group_key=methanesulphonylchloride||dimension=Environmental > media=Water > water_body=Unknown; cas=124-63-0; added Common Chemistry CAS names as altLabel: Chloro methyl sulfone, Mesyl chloride, Methanesulfochloride, Methanesulfonic acid chloride, Methanesulfonyl chloride, Methyl sulfochloride, Methylsulfonyl chloride, MsCl, NSC 15039; object_uuid=fo-3ea3520af8ed8a63 |
| 268,647 | consensus_match | cas_match_labels | — | {"124-63-0":"exactMatch"} | group_key=methanesulphonylchloride||dimension=Environmental > media=Water > water_body=Unknown; group_sources=['ec_inventory', 'pubchem']; cas_sources={'124-63-0': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-3ea3520af8ed8a63: {'124-63-0': 'exactMatch'} |
| 278,691 | opsin_iupac | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["CH3ClO2S"]… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["CH3ClO2S"]… | opsin_iupac: set authoritative IUPAC name, SMILES, InChI from 'Methanesulphonyl Chloride' |
| 285,472 | rdkit_post_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["CH3ClO2S"]… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["CH3ClO2S"]… | rdkit_post_consensus from 'CS(=O)(=O)Cl'; confirmed: smiles_string, inchi2d_string, inchi2d_key_string, molecular_formula, molecular_mass, monoisotopic_mass |
| 291,125 | strip_catalogue_altlabels | altLabel | [{"@value":"Chloro methyl sulfone","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttribut… | [{"@value":"Chloro methyl sulfone","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttribut… | Removed 1 catalogue altLabel value(s): 'NSC 15039' (registry code) |
| 323,025 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/47d21010-5420-… | associations resolved on the elementary layer |
| 393,059 | normalise_property_values | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["CH3ClO2S"]… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["CH3ClO2S"]… | typed the way the ontology types it |
| 401,824 | 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/20260822T0600486828500000/19247 | prefLabel | ef:agent/bootstrap_labels | ef:flow/47d21010-5420-475e-9506-f248073adcfd/v0 | ef:flow/47d21010-5420-475e-9506-f248073adcfd/v1 |
| ef:activity/change/20260822T0600486828500000/19248 | name | ef:agent/bootstrap_labels | ef:flow/47d21010-5420-475e-9506-f248073adcfd/v1 | ef:flow/47d21010-5420-475e-9506-f248073adcfd/v2 |
| ef:activity/change/20260822T0600486828500000/19249 | synonyms | ef:agent/bootstrap_labels | ef:flow/47d21010-5420-475e-9506-f248073adcfd/v2 | ef:flow/47d21010-5420-475e-9506-f248073adcfd/v3 |
| ef:activity/change/20260822T0600486828500000/84022 | context | ef:agent/default_context_mapping | ef:flow/47d21010-5420-475e-9506-f248073adcfd/v3 | ef:flow/47d21010-5420-475e-9506-f248073adcfd/v4 |
| ef:activity/change/20260822T0600486828500000/84023 | context_iri | ef:agent/default_context_mapping | ef:flow/47d21010-5420-475e-9506-f248073adcfd/v4 | ef:flow/47d21010-5420-475e-9506-f248073adcfd/v5 |
| ef:activity/change/20260822T0600486828500000/219610 | unit_iri | ef:agent/unit_normalization | ef:flow/47d21010-5420-475e-9506-f248073adcfd/v5 | ef:flow/47d21010-5420-475e-9506-f248073adcfd/v6 |
| ef:activity/change/20260822T0600486828500000/225471 | prefLabel | ef:agent/normalize_name_case | ef:flow/47d21010-5420-475e-9506-f248073adcfd/v6 | ef:flow/47d21010-5420-475e-9506-f248073adcfd/v7 |
| ef:activity/change/20260822T0600486828500000/245087 | properties | ef:agent/enrich_references | ef:flow/47d21010-5420-475e-9506-f248073adcfd/v7 | ef:flow/47d21010-5420-475e-9506-f248073adcfd/v8 |
| ef:activity/change/20260822T0600486828500000/245088 | skos_definition | ef:agent/enrich_references | ef:flow/47d21010-5420-475e-9506-f248073adcfd/v8 | ef:flow/47d21010-5420-475e-9506-f248073adcfd/v9 |
| ef:activity/change/20260822T0600486828500000/245089 | references | ef:agent/enrich_references | ef:flow/47d21010-5420-475e-9506-f248073adcfd/v9 | ef:flow/47d21010-5420-475e-9506-f248073adcfd/v10 |
| ef:activity/change/20260822T0600486828500000/253475 | properties | ef:agent/rdkit_pre_consensus | ef:flow/47d21010-5420-475e-9506-f248073adcfd/v10 | ef:flow/47d21010-5420-475e-9506-f248073adcfd/v11 |
| ef:activity/change/20260822T0600486828500000/268646 | altLabel | ef:agent/consensus_match | ef:flow/47d21010-5420-475e-9506-f248073adcfd/v11 | ef:flow/47d21010-5420-475e-9506-f248073adcfd/v12 |
| ef:activity/change/20260822T0600486828500000/268647 | cas_match_labels | ef:agent/consensus_match | ef:flow/47d21010-5420-475e-9506-f248073adcfd/v12 | ef:flow/47d21010-5420-475e-9506-f248073adcfd/v13 |
| ef:activity/change/20260822T0600486828500000/278691 | properties | ef:agent/opsin_iupac | ef:flow/47d21010-5420-475e-9506-f248073adcfd/v13 | ef:flow/47d21010-5420-475e-9506-f248073adcfd/v14 |
| ef:activity/change/20260822T0600486828500000/285472 | properties | ef:agent/rdkit_post_consensus | ef:flow/47d21010-5420-475e-9506-f248073adcfd/v14 | ef:flow/47d21010-5420-475e-9506-f248073adcfd/v15 |
| ef:activity/change/20260822T0600486828500000/291125 | altLabel | ef:agent/strip_catalogue_altlabels | ef:flow/47d21010-5420-475e-9506-f248073adcfd/v15 | ef:flow/47d21010-5420-475e-9506-f248073adcfd/v16 |
| ef:activity/change/20260822T0600486828500000/323025 | concept_associations | ef:agent/carry_associations_onto_flows | ef:flow/47d21010-5420-475e-9506-f248073adcfd/v16 | ef:flow/47d21010-5420-475e-9506-f248073adcfd/v17 |
| ef:activity/change/20260822T0600486828500000/393059 | properties | ef:agent/normalise_property_values | ef:flow/47d21010-5420-475e-9506-f248073adcfd/v17 | ef:flow/47d21010-5420-475e-9506-f248073adcfd/v18 |
| ef:activity/change/20260822T0600486828500000/401824 | types | ef:agent/link_flows_to_their_substance | ef:flow/47d21010-5420-475e-9506-f248073adcfd/v18 | ef:flow/47d21010-5420-475e-9506-f248073adcfd/v19 |