3-chloro-2-hydroxy-n,n,n-trimethylpropan-1-aminium Chloride
Everything that changed this substance, across every flow that resolves to it. Back to the substance
fo-3ca94aa701e39f0e
Changes
55| # | Step | Field | From | To | Why |
|---|---|---|---|---|---|
| 15,134 | bootstrap_labels | prefLabel | — | [{"@value":"3-chloro-2-hydroxy-n,n,n-trimethylpropan-1-aminium chloride","@language":"en","source":{"prov:wasGeneratedB… | Bootstrapped prefLabel from legacy name field |
| 15,135 | bootstrap_labels | name | 3-chloro-2-hydroxy-n,n,n-trimethylpropan-1-aminium chloride | — | Purged legacy name field to enforce prefLabel usage |
| 15,136 | bootstrap_labels | synonyms | ["organic","(3-chloro-2-hydroxypropyl)trimethylammoniumchloride...%","(3-chloro-2-hydroxypropyl)trimethylammoniumchlori… | [] | Removed legacy synonyms field in favor of structured labels |
| 50,552 | 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 |
| 50,553 | 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 |
| 83,886 | 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 |
| 83,887 | 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 |
| 98,946 | 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 |
| 98,947 | 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 |
| 113,498 | 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 |
| 113,499 | 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 |
| 117,232 | 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 |
| 117,233 | 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 |
| 118,922 | 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 |
| 118,923 | 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 |
| 142,956 | 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 |
| 142,957 | 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 |
| 146,304 | 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 |
| 146,305 | 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 |
| 157,322 | 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 |
| 157,323 | 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 |
| 169,942 | 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 |
| 169,943 | 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 |
| 172,156 | 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) |
| 172,157 | 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) |
| 186,902 | 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 |
| 186,903 | 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 |
| 198,748 | 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) |
| 198,749 | 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) |
| 218,324 | unit_normalization | unit_iri | — | https://vocab.brightway.one/units/unit/KiloGM | Unit IRI set from normalization of 'kg' |
| 224,581 | normalize_name_case | prefLabel | [{"@value":"3-chloro-2-hydroxy-n,n,n-trimethylpropan-1-aminium chloride","@language":"en","source":{"prov:wasGeneratedB… | [{"@value":"3-chloro-2-hydroxy-n,n,n-trimethylpropan-1-aminium Chloride","@language":"en","source":{"prov:wasGeneratedB… | Title-cased words without internal capitals (preserved words with uppercase letters beyond the first character) |
| 241,478 | enrich_references | properties | {} | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C6H15Cl2NO… | Added ChEBI/PubChem properties (chebi_ids=0, pubchem_cids=1) |
| 241,479 | enrich_references | skos_definition | — | [] | Merged ChEBI/PubChem definitions into skos:definition |
| 241,480 | enrich_references | references | [] | [{"@id":"https://chem.echa.europa.eu/100.020.045","provenance":{"prov:wasGeneratedBy":"enrich_references.pubchem_identi… | Added references with provenance; cas_numbers=['3327-22-8']; matched_chebi_ids=[]; candidate_pubchem_cids=[18732, 147580]; selected_pubchem_cids=[18732]; 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 |
| 252,439 | rdkit_pre_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C6H15Cl2NO… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C6H15Cl2NO… | rdkit_pre_consensus from 'C[N+](C)(C)CC(CCl)O.[Cl-]'; added: molecular_mass, monoisotopic_mass |
| 261,942 | consensus_match | altLabel | [] | [{"@value":"(2-Hydroxy-3-chloropropyl)trimethylammonium chloride","@language":"en","source":{"prov:wasGeneratedBy":"con… | group_key=3-chloro-2-hydroxy-n,n,n-trimethylpropan-1-aminiumchloride||dimension=Environmental > media=Air > strata=Medium stack, <150 meters > population_density=Rural (<1000 people/square mile); cas=3327-22-8; added Common Chemistry CAS names as altLabel: (2-Hydroxy-3-chloropropyl)trimethylammonium chloride, (3-Chloro-2-hydroxypropyl)-<em>N</em>,<em>N</em>,<em>N</em>-trimethylammonium chloride, (3-Chloro-2-hydroxypropyl)trimethylammonium chloride, 1-Chloro-2-hydroxypropane-3-trimethylammonium chloride, 1-Chloro-3-(trimethylammonio)-2-propanol chloride, 1-Chloro-3-trimethylammonium-2-propanol chloride, 1-Propanaminium, 3-chloro-2-hydroxy-<em>N</em>,<em>N</em>,<em>N</em>-trimethyl-, chloride, 1-Propanaminium, 3-chloro-2-hydroxy-<em>N</em>,<em>N</em>,<em>N</em>-trimethyl-, chloride (1:1), <em>N</em>-(3-Chloro-2-hydroxypropyl)-<em>N</em>,<em>N</em>,<em>N</em>-trimethylammonium chloride, Ammonium, (3-chloro-2-hydroxypropyl)trimethyl-, chloride, CHPTAC, COPA 60S, CR 2000, CR 2000 (fixative), CTA, CTA 65, CTA-YK, Catiomaster C, Catiomaster C 60, Cation Master C, Dextrosil, Dextrosil KA, Dowquat 188, EcoFAST CR 2000, HAC 65, NSC 51216, NT 21, QUAB, QUAB 188, QUAB 218, Quat 188, Reagens 65, Reagens CFZ, Reagens S, Reagens S-CFZ, Rishlyte 9098, Trimethyl(2-hydroxy-3-chloropropyl)ammonium chloride, Verolan KAF, Vircotone ECO, ZPYM 8069; object_uuid=fo-3ca94aa701e39f0e |
| 261,943 | consensus_match | cas_match_labels | — | {"3327-22-8":"exactMatch"} | group_key=3-chloro-2-hydroxy-n,n,n-trimethylpropan-1-aminiumchloride||dimension=Environmental > media=Air > strata=Medium stack, <150 meters > population_density=Rural (<1000 people/square mile); group_sources=['ec_inventory', 'pubchem']; cas_sources={'3327-22-8': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-3ca94aa701e39f0e: {'3327-22-8': 'exactMatch'} |
| 277,630 | opsin_iupac | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C6H15Cl2NO… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C6H15Cl2NO… | opsin_iupac: set authoritative IUPAC name, SMILES, InChI from '(2-Hydroxy-3-chloropropyl)trimethylammonium chloride' |
| 284,329 | rdkit_post_consensus | properties | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C6H15Cl2NO… | {"https://w3id.org/chemrof/molecular_formula":{"@id":"https://w3id.org/chemrof/molecular_formula","@value":["C6H15Cl2NO… | rdkit_post_consensus from 'C[N+](C)(C)CC(O)CCl.[Cl-]'; confirmed: smiles_string, inchi2d_string, inchi2d_key_string, molecular_formula, molecular_mass, monoisotopic_mass |
| 290,342 | strip_catalogue_altlabels | altLabel | [{"@value":"(2-Hydroxy-3-chloropropyl)trimethylammonium chloride","@language":"en","source":{"prov:wasGeneratedBy":"con… | [{"@value":"(2-Hydroxy-3-chloropropyl)trimethylammonium chloride","@language":"en","source":{"prov:wasGeneratedBy":"con… | Removed 13 catalogue altLabel value(s): 'COPA 60S' (grade code), 'CR 2000' (grade code), 'CR 2000 (fixative)' (grade code), 'CTA 65' (grade code), 'Dowquat 188' (trade name), 'HAC 65' (grade code), 'NSC 51216' (registry code), 'NT 21' (grade code), 'QUAB 188' (grade code), 'QUAB 218' (grade code), 'Quat 188' (grade code), 'Rishlyte 9098' (trade name), 'ZPYM 8069' (grade code) |
| 306,301 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/166184a6-cbdf-… | associations resolved on the elementary layer |
| 322,955 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/479e5574-4fd3-… | associations resolved on the elementary layer |
| 330,469 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/52828156-986d-… | associations resolved on the elementary layer |
| 337,746 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/6b004655-05c3-… | associations resolved on the elementary layer |
| 339,612 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/714d7d09-24db-… | associations resolved on the elementary layer |
| 340,457 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/74121a94-5bfa-… | associations resolved on the elementary layer |
| 352,478 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/9c90fd0b-a558-… | associations resolved on the elementary layer |
| 354,172 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/a2147db4-3ee3-… | associations resolved on the elementary layer |
| 359,684 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/b50af1e4-e669-… | associations resolved on the elementary layer |
| 365,995 | carry_associations_onto_flows | concept_associations | [] | [{"@type":"xkos:ConceptAssociation","xkos:sourceConcept":{"@id":"https://vocab.brightway.one/ef/3.1/flow/cae46f17-6c39-… | associations resolved on the elementary layer |