2-ethylhexyl Benzoate
Everything that changed this flow. Back to the flow
817cf4c0-1ae4-4e24-8997-ebcd5c0a29e1
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 4 catalogue altLabel value(s): 'Benzoflex 181' (trade name), 'NSC 19155' (registry code), 'SDX 3652' (grade code), 'Velate 368' (trade name) |
| 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-ethylhexylbenzoate||dimension=Environmental > media=Water > water_body=Surface water; group_sources=['ec_inventory', 'pubchem']; cas_sources={'5444-75-7': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-ad48278e367acdd3: {'5444-75-7': '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=['5444-75-7']; matched_chebi_ids=[]; candidate_pubchem_cids=[94310, 258533]; selected_pubchem_cids=[94310]; 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 |
|---|---|---|---|---|---|
| 644 | bootstrap_labels | prefLabel | — | [{"@value":"2-ethylhexyl benzoate","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:wasAttribu… | Bootstrapped prefLabel from legacy name field |
| 645 | bootstrap_labels | name | 2-ethylhexyl benzoate | — | Purged legacy name field to enforce prefLabel usage |
| 646 | bootstrap_labels | synonyms | ["organic","2-ethylhexylbenzoate","prifer6813"] | [] | Removed legacy synonyms field in favor of structured labels |
| 126,740 | 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 |
| 126,741 | 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 |
| 213,555 | unit_normalization | unit_iri | — | https://vocab.brightway.one/units/unit/KiloGM | Unit IRI set from normalization of 'kg' |
| 221,250 | normalize_name_case | prefLabel | [{"@value":"2-ethylhexyl benzoate","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:wasAttribu… | [{"@value":"2-ethylhexyl Benzoate","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:wasAttribu… | Title-cased words without internal capitals (preserved words with uppercase letters beyond the first character) |
| 227,787 | enrich_references | properties | {} | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C15H22O2"]… | Added ChEBI/PubChem properties (chebi_ids=0, pubchem_cids=1) |
| 227,788 | enrich_references | skos_definition | — | [] | Merged ChEBI/PubChem definitions into skos:definition |
| 227,789 | enrich_references | references | [] | [{"@id":"http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J210.483K","provenance":{"prov:wasGeneratedBy":"enrich_referen… | Added references with provenance; cas_numbers=['5444-75-7']; matched_chebi_ids=[]; candidate_pubchem_cids=[94310, 258533]; selected_pubchem_cids=[94310]; 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 |
| 248,488 | rdkit_pre_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C15H22O2"]… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C15H22O2"]… | rdkit_pre_consensus from 'CCCCC(CC)COC(=O)C1=CC=CC=C1'; added: molecular_mass, monoisotopic_mass |
| 260,852 | consensus_match | altLabel | [] | [{"@value":"1-Hexanol, 2-ethyl-, benzoate","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:was… | group_key=2-ethylhexylbenzoate||dimension=Environmental > media=Water > water_body=Surface water; cas=5444-75-7; added Common Chemistry CAS names as altLabel: 1-Hexanol, 2-ethyl-, benzoate, 2-Ethyl-1-hexanol benzoate, Benzoflex 181, Benzoic acid, 2-ethylhexyl ester, Ethylhexyl benzoate, Finsolv EB, Hi-Ester B 508, NSC 19155, SDX 3652, Velate 368; object_uuid=fo-ad48278e367acdd3 |
| 260,853 | consensus_match | cas_match_labels | — | {"5444-75-7":"exactMatch"} | group_key=2-ethylhexylbenzoate||dimension=Environmental > media=Water > water_body=Surface water; group_sources=['ec_inventory', 'pubchem']; cas_sources={'5444-75-7': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-ad48278e367acdd3: {'5444-75-7': 'exactMatch'} |
| 273,630 | opsin_iupac | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C15H22O2"]… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C15H22O2"]… | opsin_iupac: set authoritative IUPAC name, SMILES, InChI from '2-ethylhexyl Benzoate' |
| 279,993 | rdkit_post_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C15H22O2"]… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C15H22O2"]… | rdkit_post_consensus from 'CCCCC(CC)COC(=O)c1ccccc1'; confirmed: smiles_string, inchi2d_string, inchi2d_key_string, molecular_formula, molecular_mass, monoisotopic_mass |
| 287,396 | strip_catalogue_altlabels | altLabel | [{"@value":"1-Hexanol, 2-ethyl-, benzoate","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:was… | [{"@value":"1-Hexanol, 2-ethyl-, benzoate","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:was… | Removed 4 catalogue altLabel value(s): 'Benzoflex 181' (trade name), 'NSC 19155' (registry code), 'SDX 3652' (grade code), 'Velate 368' (trade name) |
| 344,392 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/817cf4c0-1ae4-… | associations resolved on the elementary layer |
| 387,906 | normalise_property_values | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C15H22O2"]… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C15H22O2"]… | typed the way the ontology types it |
| 394,442 | 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/20260820T1416470405690000/644 | prefLabel | ef:agent/bootstrap_labels | ef:flow/817cf4c0-1ae4-4e24-8997-ebcd5c0a29e1/v0 | ef:flow/817cf4c0-1ae4-4e24-8997-ebcd5c0a29e1/v1 |
| ef:activity/change/20260820T1416470405690000/645 | name | ef:agent/bootstrap_labels | ef:flow/817cf4c0-1ae4-4e24-8997-ebcd5c0a29e1/v1 | ef:flow/817cf4c0-1ae4-4e24-8997-ebcd5c0a29e1/v2 |
| ef:activity/change/20260820T1416470405690000/646 | synonyms | ef:agent/bootstrap_labels | ef:flow/817cf4c0-1ae4-4e24-8997-ebcd5c0a29e1/v2 | ef:flow/817cf4c0-1ae4-4e24-8997-ebcd5c0a29e1/v3 |
| ef:activity/change/20260820T1416470405690000/126740 | context | ef:agent/default_context_mapping | ef:flow/817cf4c0-1ae4-4e24-8997-ebcd5c0a29e1/v3 | ef:flow/817cf4c0-1ae4-4e24-8997-ebcd5c0a29e1/v4 |
| ef:activity/change/20260820T1416470405690000/126741 | context_iri | ef:agent/default_context_mapping | ef:flow/817cf4c0-1ae4-4e24-8997-ebcd5c0a29e1/v4 | ef:flow/817cf4c0-1ae4-4e24-8997-ebcd5c0a29e1/v5 |
| ef:activity/change/20260820T1416470405690000/213555 | unit_iri | ef:agent/unit_normalization | ef:flow/817cf4c0-1ae4-4e24-8997-ebcd5c0a29e1/v5 | ef:flow/817cf4c0-1ae4-4e24-8997-ebcd5c0a29e1/v6 |
| ef:activity/change/20260820T1416470405690000/221250 | prefLabel | ef:agent/normalize_name_case | ef:flow/817cf4c0-1ae4-4e24-8997-ebcd5c0a29e1/v6 | ef:flow/817cf4c0-1ae4-4e24-8997-ebcd5c0a29e1/v7 |
| ef:activity/change/20260820T1416470405690000/227787 | properties | ef:agent/enrich_references | ef:flow/817cf4c0-1ae4-4e24-8997-ebcd5c0a29e1/v7 | ef:flow/817cf4c0-1ae4-4e24-8997-ebcd5c0a29e1/v8 |
| ef:activity/change/20260820T1416470405690000/227788 | skos_definition | ef:agent/enrich_references | ef:flow/817cf4c0-1ae4-4e24-8997-ebcd5c0a29e1/v8 | ef:flow/817cf4c0-1ae4-4e24-8997-ebcd5c0a29e1/v9 |
| ef:activity/change/20260820T1416470405690000/227789 | references | ef:agent/enrich_references | ef:flow/817cf4c0-1ae4-4e24-8997-ebcd5c0a29e1/v9 | ef:flow/817cf4c0-1ae4-4e24-8997-ebcd5c0a29e1/v10 |
| ef:activity/change/20260820T1416470405690000/248488 | properties | ef:agent/rdkit_pre_consensus | ef:flow/817cf4c0-1ae4-4e24-8997-ebcd5c0a29e1/v10 | ef:flow/817cf4c0-1ae4-4e24-8997-ebcd5c0a29e1/v11 |
| ef:activity/change/20260820T1416470405690000/260852 | altLabel | ef:agent/consensus_match | ef:flow/817cf4c0-1ae4-4e24-8997-ebcd5c0a29e1/v11 | ef:flow/817cf4c0-1ae4-4e24-8997-ebcd5c0a29e1/v12 |
| ef:activity/change/20260820T1416470405690000/260853 | cas_match_labels | ef:agent/consensus_match | ef:flow/817cf4c0-1ae4-4e24-8997-ebcd5c0a29e1/v12 | ef:flow/817cf4c0-1ae4-4e24-8997-ebcd5c0a29e1/v13 |
| ef:activity/change/20260820T1416470405690000/273630 | properties | ef:agent/opsin_iupac | ef:flow/817cf4c0-1ae4-4e24-8997-ebcd5c0a29e1/v13 | ef:flow/817cf4c0-1ae4-4e24-8997-ebcd5c0a29e1/v14 |
| ef:activity/change/20260820T1416470405690000/279993 | properties | ef:agent/rdkit_post_consensus | ef:flow/817cf4c0-1ae4-4e24-8997-ebcd5c0a29e1/v14 | ef:flow/817cf4c0-1ae4-4e24-8997-ebcd5c0a29e1/v15 |
| ef:activity/change/20260820T1416470405690000/287396 | altLabel | ef:agent/strip_catalogue_altlabels | ef:flow/817cf4c0-1ae4-4e24-8997-ebcd5c0a29e1/v15 | ef:flow/817cf4c0-1ae4-4e24-8997-ebcd5c0a29e1/v16 |
| ef:activity/change/20260820T1416470405690000/344392 | concept_associations | ef:agent/carry_associations_onto_flows | ef:flow/817cf4c0-1ae4-4e24-8997-ebcd5c0a29e1/v16 | ef:flow/817cf4c0-1ae4-4e24-8997-ebcd5c0a29e1/v17 |
| ef:activity/change/20260820T1416470405690000/387906 | properties | ef:agent/normalise_property_values | ef:flow/817cf4c0-1ae4-4e24-8997-ebcd5c0a29e1/v17 | ef:flow/817cf4c0-1ae4-4e24-8997-ebcd5c0a29e1/v18 |
| ef:activity/change/20260820T1416470405690000/394442 | types | ef:agent/link_flows_to_their_substance | ef:flow/817cf4c0-1ae4-4e24-8997-ebcd5c0a29e1/v18 | ef:flow/817cf4c0-1ae4-4e24-8997-ebcd5c0a29e1/v19 |