3-({[(tert-butylperoxy)carbonyl]oxy}methyl)heptane
Everything that changed this substance, across every flow that resolves to it. Back to the substance
fo-7750b803434acc0f
Changes
55| # | Step | Field | From | To | Why |
|---|---|---|---|---|---|
| 15,283 | bootstrap_labels | prefLabel | — | [{"@value":"3-({[(tert-butylperoxy)carbonyl]oxy}methyl)heptane","@language":"en","source":{"prov:wasGeneratedBy":"boots… | Bootstrapped prefLabel from legacy name field |
| 15,284 | bootstrap_labels | name | 3-({[(tert-butylperoxy)carbonyl]oxy}methyl)heptane | — | Purged legacy name field to enforce prefLabel usage |
| 15,285 | bootstrap_labels | synonyms | ["organic","oo-tert-butylo-(2-ethylhexyl)peroxycarbonate","novipermc1","trigonox117"] | [] | Removed legacy synonyms field in favor of structured labels |
| 50,861 | default_context_mapping | context | — | {"dimension":"Environmental","media":"Air","strata":"Long-term"} | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to air > Emissions to air, unspecified (long-term) |
| 50,862 | default_context_mapping | context_iri | — | https://vocab.brightway.one/flow-contexts/envi-air-lote | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to air > Emissions to air, unspecified (long-term) |
| 54,161 | 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) |
| 54,162 | 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) |
| 80,347 | default_context_mapping | context | — | {"dimension":"Environmental","media":"Water","water_body":"Surface water"} | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to water > Emissions to fresh water |
| 80,348 | default_context_mapping | context_iri | — | https://vocab.brightway.one/flow-contexts/envi-wate-suwa | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to water > Emissions to fresh water |
| 84,781 | 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 |
| 84,782 | 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 |
| 99,579 | default_context_mapping | context | — | {"dimension":"Environmental","media":"Water","water_body":"Ocean"} | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to water > Emissions to sea water |
| 99,580 | default_context_mapping | context_iri | — | https://vocab.brightway.one/flow-contexts/envi-wate-ocea | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to water > Emissions to sea water |
| 106,471 | default_context_mapping | context | — | {"dimension":"Environmental","media":"Water","water_body":"Unknown"} | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to water > Emissions to water, unspecified |
| 106,472 | default_context_mapping | context_iri | — | https://vocab.brightway.one/flow-contexts/envi-wate-unkn | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to water > Emissions to water, unspecified |
| 138,521 | default_context_mapping | context | — | {"dimension":"Environmental","media":"Air","strata":"Aircraft cruise height"} | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to air > Emissions to lower stratosphere and upper troposphere |
| 138,522 | default_context_mapping | context_iri | — | https://vocab.brightway.one/flow-contexts/envi-air-aicrhe | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to air > Emissions to lower stratosphere and upper troposphere |
| 149,977 | default_context_mapping | context | — | {"dimension":"Environmental","media":"Ground","geography":"Non-agricultural"} | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to soil > Emissions to non-agricultural soil |
| 149,978 | default_context_mapping | context_iri | — | https://vocab.brightway.one/flow-contexts/envi-grou-noag | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to soil > Emissions to non-agricultural soil |
| 158,289 | 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 |
| 158,290 | 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 |
| 176,133 | default_context_mapping | context | — | {"dimension":"Environmental","media":"Ground","geography":"Agricultural"} | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to soil > Emissions to agricultural soil |
| 176,134 | default_context_mapping | context_iri | — | https://vocab.brightway.one/flow-contexts/envi-grou-agri | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to soil > Emissions to agricultural soil |
| 184,191 | default_context_mapping | context | — | {"dimension":"Environmental","media":"Air","strata":"Medium stack, <150 meters","population_density":"Rural (<1000 peop… | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to air > Emissions to non-urban air or from high stacks |
| 184,192 | default_context_mapping | context_iri | — | https://vocab.brightway.one/flow-contexts/envi-air-mest15me-ru10pesq | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to air > Emissions to non-urban air or from high stacks |
| 195,681 | default_context_mapping | context | — | {"dimension":"Environmental","media":"Ground","geography":"Unknown"} | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to soil > Emissions to soil, unspecified |
| 195,682 | default_context_mapping | context_iri | — | https://vocab.brightway.one/flow-contexts/envi-grou-unkn | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to soil > Emissions to soil, unspecified |
| 195,707 | default_context_mapping | context | — | {"dimension":"Environmental","media":"Air","indoor":"Unknown"} | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to air > Emissions to air, indoor |
| 195,708 | default_context_mapping | context_iri | — | https://vocab.brightway.one/flow-contexts/envi-air-indr-unkn | Mapped from context mapping for source=EF 3.1, source context Emissions > Emissions to air > Emissions to air, indoor |
| 218,372 | unit_normalization | unit_iri | — | https://vocab.brightway.one/units/unit/KiloGM | Unit IRI set from normalization of 'kg' |
| 241,609 | enrich_references | properties | {} | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C13H26O4"]… | Added ChEBI/PubChem properties (chebi_ids=0, pubchem_cids=1) |
| 241,610 | enrich_references | skos_definition | — | [] | Merged ChEBI/PubChem definitions into skos:definition |
| 241,611 | enrich_references | references | [] | [{"@id":"http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J250.892C","provenance":{"prov:wasGeneratedBy":"enrich_referen… | Added references with provenance; cas_numbers=['34443-12-4']; matched_chebi_ids=[]; candidate_pubchem_cids=[61931, 5157542, 22245461, 92168490]; selected_pubchem_cids=[61931]; 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 |
| 252,480 | rdkit_pre_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C13H26O4"]… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C13H26O4"]… | rdkit_pre_consensus from 'CCCCC(CC)COC(=O)OOC(C)(C)C'; added: molecular_mass, monoisotopic_mass |
| 261,839 | consensus_match | altLabel | [] | [{"@value":"2-Ethylhexyl <em>tert</em>-Butyl peroxy carbonate","@language":"en","source":{"prov:wasGeneratedBy":"consen… | group_key=3-({[(tert-butylperoxy)carbonyl]oxy}methyl)heptane||dimension=Environmental > media=Air > strata=Long-term; cas=34443-12-4; added Common Chemistry CAS names as altLabel: 2-Ethylhexyl <em>tert</em>-Butyl peroxy carbonate, <em>O</em>-(2-Ethylhexyl) <em>OO</em>-<em>tert</em>-butyl peroxycarbonate, <em>OO</em>-<em>tert</em>-Butyl <em>O</em>-(2-ethylhexyl) peroxycarbonate, <em>OO</em>-<em>tert</em>-butyl <em>O</em>-(2-ethylhexyl) monoperoxycarbonate, <em>tert</em>-Butyl 2-ethylhexyl monopercarbonate, <em>tert</em>-Butyl(2-ethylhexyl)monoperoxycarbonate, <em>tert</em>-Butylperoxy 2-ethylhexyl carbonate, <em>tert</em>-Butylperoxy 2-ethylhexyl monocarbonate, Carbonoperoxoic acid, <em>OO</em>-(1,1-dimethylethyl) <em>O</em>-(2-ethylhexyl) ester, Esperox C 496, Luperox TBEC, Lupersol TBEC, Perbutyl E, Peroxan BEC, Peroxycarbonic acid, <em>OO</em>-<em>tert</em>-butyl <em>O</em>-(2-ethylhexyl) ester, T 117, TBEC, Trigonox 117, Tx 117; object_uuid=fo-7750b803434acc0f |
| 261,840 | consensus_match | cas_match_labels | — | {"34443-12-4":"exactMatch"} | group_key=3-({[(tert-butylperoxy)carbonyl]oxy}methyl)heptane||dimension=Environmental > media=Air > strata=Long-term; group_sources=['ec_inventory', 'pubchem']; cas_sources={'34443-12-4': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-7750b803434acc0f: {'34443-12-4': 'exactMatch'} |
| 277,675 | opsin_iupac | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C13H26O4"]… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C13H26O4"]… | opsin_iupac: set authoritative IUPAC name, SMILES, InChI from 'tert-Butylperoxy 2-ethylhexyl carbonate' |
| 284,374 | rdkit_post_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C13H26O4"]… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C13H26O4",… | rdkit_post_consensus from 'CCCCC(CC)COC(=O)OOOC(C)(C)C'; added: inchi2d_key_string, molecular_formula, molecular_mass, monoisotopic_mass; confirmed: smiles_string, inchi2d_string |
| 286,694 | withhold_contradicted_composition | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C13H26O4",… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C13H26O4"]… | withhold_contradicted_composition: the registry registers [(('C', 13), ('O', 4))], contradicting ['C13H26O5'] from ['rdkit_post_consensus']; withdrew inchi2d_key_string x1, molecular_formula x1, molecular_mass x1, monoisotopic_mass x1 |
| 290,384 | strip_catalogue_altlabels | altLabel | [{"@value":"2-Ethylhexyl <em>tert</em>-Butyl peroxy carbonate","@language":"en","source":{"prov:wasGeneratedBy":"consen… | [{"@value":"2-Ethylhexyl tert-Butyl peroxy carbonate","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match… | Removed 3 catalogue altLabel value(s): 'T 117' (grade code), 'Trigonox 117' (trade name), 'Tx 117' (grade code) |
| 306,496 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/16f7d2d9-a0ac-… | associations resolved on the elementary layer |
| 308,146 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/1ab6fa4b-dc2e-… | associations resolved on the elementary layer |
| 321,224 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/4165ebbe-13b1-… | associations resolved on the elementary layer |
| 323,443 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/492dec8e-819d-… | associations resolved on the elementary layer |
| 330,823 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/539500f7-65e2-… | associations resolved on the elementary layer |
| 334,269 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/5f7bd2ba-6351-… | associations resolved on the elementary layer |
| 350,296 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/9552d684-c4b6-… | associations resolved on the elementary layer |
| 356,041 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/a86512c5-8e34-… | associations resolved on the elementary layer |
| 360,199 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/b6c2c6ee-0a92-… | associations resolved on the elementary layer |
| 369,120 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/d54c0333-b926-… | associations resolved on the elementary layer |