3-chloropropane-1,2-diol
Everything that changed this substance, across every flow that resolves to it. Back to the substance
fo-13ec556c2589e1bc
Changes
56| # | Step | Field | From | To | Why |
|---|---|---|---|---|---|
| 332 | bootstrap_labels | prefLabel | — | [{"@value":"3-chloropropane-1,2-diol","@language":"en","source":{"prov:wasGeneratedBy":"bootstrap_labels","prov:wasAttr… | Bootstrapped prefLabel from legacy name field |
| 333 | bootstrap_labels | name | 3-chloropropane-1,2-diol | — | Purged legacy name field to enforce prefLabel usage |
| 334 | bootstrap_labels | synonyms | ["(+-)-2,3-Dihydroxychloropropane","(+/-)-3-Chloro-1,2-propanediol","(RS)-3-chloro-1,2-propanediol",".alpha.-Chlorohydr… | [] | Removed legacy synonyms field in favor of structured labels |
| 23,263 | bootstrap_labels | synonyms | ["3-chloropropane-1,2-diol","alpha-chlorohydrin","glycerol alpha-monochlorohydrin","3-chloro-1,2-propanediol","1,2-prop… | [] | Removed legacy synonyms field in favor of structured labels |
| 26,120 | 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 |
| 26,121 | 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 |
| 27,232 | 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 |
| 27,233 | 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 |
| 105,978 | 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 |
| 105,979 | 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 |
| 112,900 | 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 |
| 112,901 | 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 |
| 129,796 | 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 |
| 129,797 | 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 |
| 135,734 | 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 |
| 135,735 | 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 |
| 156,388 | 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 |
| 156,389 | 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 |
| 160,866 | 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) |
| 160,867 | 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) |
| 161,814 | 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 |
| 161,815 | 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 |
| 165,954 | 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 |
| 165,955 | 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 |
| 167,264 | 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 |
| 167,265 | 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 |
| 185,962 | 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) |
| 185,963 | 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) |
| 186,172 | 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 |
| 186,173 | 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 |
| 213,449 | unit_normalization | unit_iri | — | https://vocab.brightway.one/units/unit/KiloGM | Unit IRI set from normalization of 'kg' |
| 227,487 | enrich_references | properties | {} | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C3H7ClO2"]… | Added ChEBI/PubChem properties (chebi_ids=1, pubchem_cids=1) |
| 227,488 | enrich_references | skos_definition | — | [{"@value":"A chloropropane-1,2-diol that is propane-1,2-diol substituted by a chloro group at position 3.","@language"… | Merged ChEBI/PubChem definitions into skos:definition |
| 227,489 | enrich_references | references | [] | [{"@id":"beilstein:635684","provenance":{"prov:wasGeneratedBy":"enrich_references.chebi_xrefs","prov:wasAttributedTo":"… | Added references with provenance; cas_numbers=['96-24-2']; matched_chebi_ids=['http://purl.obolibrary.org/obo/CHEBI_18721']; candidate_pubchem_cids=[3503, 7290, 148904]; selected_pubchem_cids=[7290]; 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 |
| 248,405 | rdkit_pre_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C3H7ClO2"]… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C3H7ClO2"]… | rdkit_pre_consensus from 'C(C(CCl)O)O'; added: monoisotopic_mass |
| 254,425 | chebi_altlabels | altLabel | [] | [{"@value":"(RS)-3-chloro-1,2-propanediol","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov:was… | Added 6 ChEBI synonym(s) as altLabel from 1 linked ChEBI record(s) |
| 261,992 | consensus_match | altLabel | [{"@value":"(RS)-3-chloro-1,2-propanediol","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov:was… | [{"@value":"(RS)-3-chloro-1,2-propanediol","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov:was… | group_key=3-chloropropane-1,2-diol||dimension=Environmental > media=Water > water_body=Unknown; cas=96-24-2; added Common Chemistry CAS names as altLabel: (<em>RS</em>)-α-Chlorohydrin, (±)-2,3-Dihydroxychloropropane, (±)-3-Chloro-1,2-propanediol, 1,2-Dihydroxy-3-chloropropane, 1,2-Propanediol, 3-chloro-, 1-Chloro-1-deoxyglycerol, 1-Chloro-2,3-dihydroxypropane, 3-Chloro-1,2-dihydroxypropane, 3-Chloro-1,2-propylene glycol, 3-Chloropropanediol, 3-Chloropropylene glycol, <em>dl</em>-α-Chlorohydrin, Chlorohydrin, Chloropropanediol, Ekorod A, Epibloc, Glycerin epichlorohydrin, Glycerin monochlorohydrin, Glycerin α-monochlorhydrin, Glycerol 3-chlorohydrin, Glycerol monochlorohydrin, Glycerol α-chlorohydrin, Glycerol α-monochlorohydrin, Glyceryl chloride, Glyceryl α-chlorohydrin, U 5897, α-Chlorohydrin, α-Monochlorohydrin; object_uuid=fo-13ec556c2589e1bc |
| 261,993 | consensus_match | cas_match_labels | — | {"96-24-2":"exactMatch"} | group_key=3-chloropropane-1,2-diol||dimension=Environmental > media=Water > water_body=Unknown; group_sources=['chebi', 'ec_inventory', 'pubchem']; cas_sources={'96-24-2': ['chebi', 'ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-13ec556c2589e1bc: {'96-24-2': 'exactMatch'} |
| 273,545 | opsin_iupac | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C3H7ClO2"]… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C3H7ClO2"]… | opsin_iupac: set authoritative IUPAC name, SMILES, InChI from '3-chloropropane-1,2-diol' |
| 279,902 | rdkit_post_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C3H7ClO2"]… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C3H7ClO2"]… | rdkit_post_consensus from 'OCC(O)CCl'; confirmed: smiles_string, inchi2d_string, inchi2d_key_string, molecular_formula, molecular_mass, monoisotopic_mass |
| 287,336 | strip_catalogue_altlabels | altLabel | [{"@value":"(RS)-3-chloro-1,2-propanediol","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov:was… | [{"@value":"(RS)-3-chloro-1,2-propanediol","@language":"en","source":{"prov:wasGeneratedBy":"chebi_altlabels","prov:was… | Removed 1 catalogue altLabel value(s): 'U 5897' (grade code) |
| 294,124 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/005ab6d2-b095-… | associations resolved on the elementary layer |
| 294,680 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/024c6449-21b0-… | associations resolved on the elementary layer |
| 334,007 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/5eb6cd69-f3b9-… | associations resolved on the elementary layer |
| 337,469 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/69fbf9d4-3315-… | associations resolved on the elementary layer |
| 345,919 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/868700d9-5fe0-… | associations resolved on the elementary layer |
| 348,883 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/90a18aa6-9a48-… | associations resolved on the elementary layer |
| 359,239 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/b364a746-7a4a-… | associations resolved on the elementary layer |
| 361,477 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/bb4b95cc-adbc-… | associations resolved on the elementary layer |
| 361,952 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/bcebc679-e894-… | associations resolved on the elementary layer |