3-isocyanatopropyl(trimethoxy)silane
Everything that changed this flow. Back to the flow
58c876e9-3c9b-464b-b31e-bda8f3654680
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 14 catalogue altLabel value(s): 'CFS 006' (grade code), 'GF 40' (grade code), 'IC 301' (grade code), 'KBE 900' (grade code), 'KBK 9007' (grade code), 'KBM 9007A' (grade code), 'KBM 9007N' (grade code), 'KH 901' (grade code), 'QX 335' (grade code), 'SI 335' (grade code), 'Silong 9907M' (trade name), 'T 03' (grade code), 'W 5322C' (grade code), 'Y 5187' (grade code) |
| cas_match_labels | 1 | consensus_match | group_key=3-isocyanatopropyl(trimethoxy)silane||dimension=Environmental > media=Air > strata=Aircraft cruise height; group_sources=['ec_inventory', 'pubchem']; cas_sources={'15396-00-6': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-e6f20bb1b0288ed4: {'15396-00-6': '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 air, unspecified |
| context_iri | 1 | default_context_mapping | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to air > Emissions to air, 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=['15396-00-6']; matched_chebi_ids=[]; candidate_pubchem_cids=[84892, 160033, 21958202, 129893428]; selected_pubchem_cids=[84892]; 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 |
|---|---|---|---|---|---|
| 17,606 | bootstrap_labels | prefLabel | — | [{"@value":"3-isocyanatopropyl(trimethoxy)silane","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","… | Bootstrapped prefLabel from legacy name field |
| 17,607 | bootstrap_labels | name | 3-isocyanatopropyl(trimethoxy)silane | — | Purged legacy name field to enforce prefLabel usage |
| 17,608 | bootstrap_labels | synonyms | ["inorganic","3-(trimethoxysilyl)propylisocyanate","a-35link","silquesty-5187"] | [] | Removed legacy synonyms field in favor of structured labels |
| 102,553 | default_context_mapping | context | — | {"dimension":"Environmental","media":"Air","strata":"Unknown"} | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to air > Emissions to air, unspecified |
| 102,554 | default_context_mapping | context_iri | — | https://vocab.brightway.one/flow-contexts/envi-air-unkn | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to air > Emissions to air, unspecified |
| 219,109 | unit_normalization | unit_iri | — | https://vocab.brightway.one/units/unit/KiloGM | Unit IRI set from normalization of 'kg' |
| 243,676 | enrich_references | properties | {} | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C7H15NO4Si… | Added ChEBI/PubChem properties (chebi_ids=0, pubchem_cids=1) |
| 243,677 | enrich_references | skos_definition | — | [] | Merged ChEBI/PubChem definitions into skos:definition |
| 243,678 | enrich_references | references | [] | [{"@id":"http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J195.938G","provenance":{"prov:wasGeneratedBy":"enrich_referen… | Added references with provenance; cas_numbers=['15396-00-6']; matched_chebi_ids=[]; candidate_pubchem_cids=[84892, 160033, 21958202, 129893428]; selected_pubchem_cids=[84892]; 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 |
| 253,075 | rdkit_pre_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C7H15NO4Si… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C7H15NO4Si… | rdkit_pre_consensus from 'CO[Si](CCCN=C=O)(OC)OC'; added: molecular_mass, monoisotopic_mass |
| 262,053 | consensus_match | altLabel | [] | [{"@value":"(3-Isocyanatopropyl)trimethoxysilane","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","p… | group_key=3-isocyanatopropyl(trimethoxy)silane||dimension=Environmental > media=Air > strata=Aircraft cruise height; cas=15396-00-6; added Common Chemistry CAS names as altLabel: (3-Isocyanatopropyl)trimethoxysilane, (γ-Isocyanatopropyl)trimethoxysilane, 1-Isocyanato-3-trimethoxysilylpropane, 3-(Trimethoxysilyl)propyl isocyanate, 3-Isocyanate propyltrimethoxysilane, 3-Isocyanopropyltrimethoxysilane, 3-Isocyantopropyltrimethoxysilane, A-Link 35, A11262, CFS 006, GF 40, Geniosil GF 40, IC 301, Isocyanic acid, 3-(trimethoxysilyl)propyl ester, Isocyanopropyl trimethoxy silane, KBE 900, KBK 9007, KBM 9007A, KBM 9007N, KH 901, QX 335, SCA-Y 25M, SI 335, SII 6456.0, Sanfu SI 335, Silane, (3-isocyanatopropyl)trimethoxy-, Silong 9907M, Silquest A-Link 35, Silquest Y 5187, T 03, Trimethoxy(3-isocyanatopropyl)silane, USi-SL 35, Unisilan 18, Vestanat EP-IPMS, W 5322C, Y 5187, γ-Isocyanopropyltrimethoxysilane; object_uuid=fo-e6f20bb1b0288ed4 |
| 262,054 | consensus_match | cas_match_labels | — | {"15396-00-6":"exactMatch"} | group_key=3-isocyanatopropyl(trimethoxy)silane||dimension=Environmental > media=Air > strata=Aircraft cruise height; group_sources=['ec_inventory', 'pubchem']; cas_sources={'15396-00-6': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-e6f20bb1b0288ed4: {'15396-00-6': 'exactMatch'} |
| 278,273 | opsin_iupac | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C7H15NO4Si… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C7H15NO4Si… | opsin_iupac: set authoritative IUPAC name, SMILES, InChI from '3-isocyanatopropyl(trimethoxy)silane' |
| 285,023 | rdkit_post_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C7H15NO4Si… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C7H15NO4Si… | rdkit_post_consensus from 'CO[Si](CCCN=C=O)(OC)OC'; confirmed: smiles_string, inchi2d_string, inchi2d_key_string, molecular_formula, molecular_mass, monoisotopic_mass |
| 290,820 | strip_catalogue_altlabels | altLabel | [{"@value":"(3-Isocyanatopropyl)trimethoxysilane","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","p… | [{"@value":"(3-Isocyanatopropyl)trimethoxysilane","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","p… | Removed 14 catalogue altLabel value(s): 'CFS 006' (grade code), 'GF 40' (grade code), 'IC 301' (grade code), 'KBE 900' (grade code), 'KBK 9007' (grade code), 'KBM 9007A' (grade code), 'KBM 9007N' (grade code), 'KH 901' (grade code), 'QX 335' (grade code), 'SI 335' (grade code), 'Silong 9907M' (trade name), 'T 03' (grade code), 'W 5322C' (grade code), 'Y 5187' (grade code) |
| 332,305 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/58c876e9-3c9b-… | associations resolved on the elementary layer |
| 392,656 | normalise_property_values | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C7H15NO4Si… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C7H15NO4Si… | typed the way the ontology types it |
| 401,222 | 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/20261021T0746548129760000/17606 | prefLabel | ef:agent/bootstrap_labels | ef:flow/58c876e9-3c9b-464b-b31e-bda8f3654680/v0 | ef:flow/58c876e9-3c9b-464b-b31e-bda8f3654680/v1 |
| ef:activity/change/20261021T0746548129760000/17607 | name | ef:agent/bootstrap_labels | ef:flow/58c876e9-3c9b-464b-b31e-bda8f3654680/v1 | ef:flow/58c876e9-3c9b-464b-b31e-bda8f3654680/v2 |
| ef:activity/change/20261021T0746548129760000/17608 | synonyms | ef:agent/bootstrap_labels | ef:flow/58c876e9-3c9b-464b-b31e-bda8f3654680/v2 | ef:flow/58c876e9-3c9b-464b-b31e-bda8f3654680/v3 |
| ef:activity/change/20261021T0746548129760000/102553 | context | ef:agent/default_context_mapping | ef:flow/58c876e9-3c9b-464b-b31e-bda8f3654680/v3 | ef:flow/58c876e9-3c9b-464b-b31e-bda8f3654680/v4 |
| ef:activity/change/20261021T0746548129760000/102554 | context_iri | ef:agent/default_context_mapping | ef:flow/58c876e9-3c9b-464b-b31e-bda8f3654680/v4 | ef:flow/58c876e9-3c9b-464b-b31e-bda8f3654680/v5 |
| ef:activity/change/20261021T0746548129760000/219109 | unit_iri | ef:agent/unit_normalization | ef:flow/58c876e9-3c9b-464b-b31e-bda8f3654680/v5 | ef:flow/58c876e9-3c9b-464b-b31e-bda8f3654680/v6 |
| ef:activity/change/20261021T0746548129760000/243676 | properties | ef:agent/enrich_references | ef:flow/58c876e9-3c9b-464b-b31e-bda8f3654680/v6 | ef:flow/58c876e9-3c9b-464b-b31e-bda8f3654680/v7 |
| ef:activity/change/20261021T0746548129760000/243677 | skos_definition | ef:agent/enrich_references | ef:flow/58c876e9-3c9b-464b-b31e-bda8f3654680/v7 | ef:flow/58c876e9-3c9b-464b-b31e-bda8f3654680/v8 |
| ef:activity/change/20261021T0746548129760000/243678 | references | ef:agent/enrich_references | ef:flow/58c876e9-3c9b-464b-b31e-bda8f3654680/v8 | ef:flow/58c876e9-3c9b-464b-b31e-bda8f3654680/v9 |
| ef:activity/change/20261021T0746548129760000/253075 | properties | ef:agent/rdkit_pre_consensus | ef:flow/58c876e9-3c9b-464b-b31e-bda8f3654680/v9 | ef:flow/58c876e9-3c9b-464b-b31e-bda8f3654680/v10 |
| ef:activity/change/20261021T0746548129760000/262053 | altLabel | ef:agent/consensus_match | ef:flow/58c876e9-3c9b-464b-b31e-bda8f3654680/v10 | ef:flow/58c876e9-3c9b-464b-b31e-bda8f3654680/v11 |
| ef:activity/change/20261021T0746548129760000/262054 | cas_match_labels | ef:agent/consensus_match | ef:flow/58c876e9-3c9b-464b-b31e-bda8f3654680/v11 | ef:flow/58c876e9-3c9b-464b-b31e-bda8f3654680/v12 |
| ef:activity/change/20261021T0746548129760000/278273 | properties | ef:agent/opsin_iupac | ef:flow/58c876e9-3c9b-464b-b31e-bda8f3654680/v12 | ef:flow/58c876e9-3c9b-464b-b31e-bda8f3654680/v13 |
| ef:activity/change/20261021T0746548129760000/285023 | properties | ef:agent/rdkit_post_consensus | ef:flow/58c876e9-3c9b-464b-b31e-bda8f3654680/v13 | ef:flow/58c876e9-3c9b-464b-b31e-bda8f3654680/v14 |
| ef:activity/change/20261021T0746548129760000/290820 | altLabel | ef:agent/strip_catalogue_altlabels | ef:flow/58c876e9-3c9b-464b-b31e-bda8f3654680/v14 | ef:flow/58c876e9-3c9b-464b-b31e-bda8f3654680/v15 |
| ef:activity/change/20261021T0746548129760000/332305 | concept_associations | ef:agent/carry_associations_onto_flows | ef:flow/58c876e9-3c9b-464b-b31e-bda8f3654680/v15 | ef:flow/58c876e9-3c9b-464b-b31e-bda8f3654680/v16 |
| ef:activity/change/20261021T0746548129760000/392656 | properties | ef:agent/normalise_property_values | ef:flow/58c876e9-3c9b-464b-b31e-bda8f3654680/v16 | ef:flow/58c876e9-3c9b-464b-b31e-bda8f3654680/v17 |
| ef:activity/change/20261021T0746548129760000/401222 | types | ef:agent/link_flows_to_their_substance | ef:flow/58c876e9-3c9b-464b-b31e-bda8f3654680/v17 | ef:flow/58c876e9-3c9b-464b-b31e-bda8f3654680/v18 |