2,4-dichlorophenoxyacetic Acid, Isoproplyamine Salt
b07c6f0006fca906d70791ed09f3e264c46acda2
Identity
- Substance
- fo-5f6ca937aa0e11e9 Molecular complex
- Source
- stepwise algorithm addition
- Unit
- kg
- Context
- Environmental → Water → Unconfined aquifer
- CAS
- 5742-17-6
- EC
- —
Context
- Dimension
- Environmental
- Media
- Water
- Water body
- Unconfined aquifer
Alternative labels
10- (2,4-Dichlorophenoxy)acetic acid isopropylamine salt
- 2,4-D isopropylamine salt
- 2,4-D isopropylammonium salt
- 2-Propanamine, (2,4-dichlorophenoxy)acetate
- 2-Propanaminium (2,4-dichlorophenoxy)acetate
- Acetic acid, (2,4-dichlorophenoxy)-, compd. with 2-propanamine (1:1)
- Acetic acid, (2,4-dichlorophenoxy)-, compd. with isopropylamine (1:1)
- Acetic acid, (2,4-dichlorophenoxy)-, isopropylamine salt
- Acetic acid, 2-(2,4-dichlorophenoxy)-, compd. with 2-propanamine (1:1)
- Isopropylamine, compd. with (2,4-dichlorophenoxy)acetic acid (1:1)
Source lists
1| List | Version | Source flow | Name there | Why this flow |
|---|---|---|---|---|
| stepwise | 2006-1.09 | a030e433-d020-58e7-a596-8d8ad902503b | 2,4-D, isopropylamine salt | The CAS numbers are the same (5742-17-6); no flow of this substance sat in that compartment, so this one was created for the row. |
Concept associations
1| Source list | Source flow | Name there | Compartment there | Match | Conversion |
|---|---|---|---|---|---|
| stepwise 2006-1.09 | a030e433-d020-58e7-a596-8d8ad902503b | 2,4-D, Isopropylamine Salt | Water / groundwater | exactMatch | — |
Characterisation factors
4- brightway-flows 2
- 2.-0 LCA consultants 2
Every implementation that says anything about this flow. Published as is what this list did with the row: where more than one implementation states a number and they agree it publishes it as agreed; where only one speaks, as sole; where they disagree it publishes nothing and asks.
| Method | Implementation | Category | Place | Factor | Published as |
|---|---|---|---|---|---|
| Stepwise 2006 | 2.-0 LCA consultants | Ecotoxicity, aquatic | — | 0.034373 | — |
| Stepwise 2006 | brightway-flows | Ecotoxicity, aquatic | — | 0.034373 | sole |
| Stepwise 2006 | 2.-0 LCA consultants | Ecotoxicity, terrestrial | — | 1.1000e-09 | — |
| Stepwise 2006 | brightway-flows | Ecotoxicity, terrestrial | — | 1.1000e-09 | sole |
History
The change log and the PROV-O trail (0 consensus changes)
These are the heaviest sections of this page and the least often read, so the page does not pay for them until you ask.
Full record
Flow JSON
{
"altLabel": [
{
"@value": "(2,4-Dichlorophenoxy)acetic acid isopropylamine salt",
"@language": "en",
"@lang": "en",
"provenance": {
"prov:wasGeneratedBy": "consensus_match",
"prov:wasAttributedTo": "brightway-flows",
"prov:hadPrimarySource": [
"CAS:5742-17-6",
"EF 3.1",
"https://commonchemistry.cas.org/detail?cas_rn=5742-17-6"
],
"prov:wasDerivedFrom": "common chemistry CAS lookup"
}
},
{
"@value": "2,4-D isopropylamine salt",
"@language": "en",
"@lang": "en",
"provenance": {
"prov:wasGeneratedBy": "consensus_match",
"prov:wasAttributedTo": "brightway-flows",
"prov:hadPrimarySource": [
"CAS:5742-17-6",
"EF 3.1",
"https://commonchemistry.cas.org/detail?cas_rn=5742-17-6"
],
"prov:wasDerivedFrom": "common chemistry CAS lookup"
}
},
{
"@value": "2,4-D isopropylammonium salt",
"@language": "en",
"@lang": "en",
"provenance": {
"prov:wasGeneratedBy": "consensus_match",
"prov:wasAttributedTo": "brightway-flows",
"prov:hadPrimarySource": [
"CAS:5742-17-6",
"EF 3.1",
"https://commonchemistry.cas.org/detail?cas_rn=5742-17-6"
],
"prov:wasDerivedFrom": "common chemistry CAS lookup"
}
},
{
"@value": "2-Propanamine, (2,4-dichlorophenoxy)acetate",
"@language": "en",
"@lang": "en",
"provenance": {
"prov:wasGeneratedBy": "consensus_match",
"prov:wasAttributedTo": "brightway-flows",
"prov:hadPrimarySource": [
"CAS:5742-17-6",
"EF 3.1",
"https://commonchemistry.cas.org/detail?cas_rn=5742-17-6"
],
"prov:wasDerivedFrom": "common chemistry CAS lookup"
}
},
{
"@value": "2-Propanaminium (2,4-dichlorophenoxy)acetate",
"@language": "en",
"@lang": "en",
"provenance": {
"prov:wasGeneratedBy": "consensus_match",
"prov:wasAttributedTo": "brightway-flows",
"prov:hadPrimarySource": [
"CAS:5742-17-6",
"EF 3.1",
"https://commonchemistry.cas.org/detail?cas_rn=5742-17-6"
],
"prov:wasDerivedFrom": "common chemistry CAS lookup"
}
},
{
"@value": "Acetic acid, (2,4-dichlorophenoxy)-, compd. with 2-propanamine (1:1)",
"@language": "en",
"@lang": "en",
"provenance": {
"prov:wasGeneratedBy": "consensus_match",
"prov:wasAttributedTo": "brightway-flows",
"prov:hadPrimarySource": [
"CAS:5742-17-6",
"EF 3.1",
"https://commonchemistry.cas.org/detail?cas_rn=5742-17-6"
],
"prov:wasDerivedFrom": "common chemistry CAS lookup"
}
},
{
"@value": "Acetic acid, (2,4-dichlorophenoxy)-, compd. with isopropylamine (1:1)",
"@language": "en",
"@lang": "en",
"provenance": {
"prov:wasGeneratedBy": "consensus_match",
"prov:wasAttributedTo": "brightway-flows",
"prov:hadPrimarySource": [
"CAS:5742-17-6",
"EF 3.1",
"https://commonchemistry.cas.org/detail?cas_rn=5742-17-6"
],
"prov:wasDerivedFrom": "common chemistry CAS lookup"
}
},
{
"@value": "Acetic acid, (2,4-dichlorophenoxy)-, isopropylamine salt",
"@language": "en",
"@lang": "en",
"provenance": {
"prov:wasGeneratedBy": "consensus_match",
"prov:wasAttributedTo": "brightway-flows",
"prov:hadPrimarySource": [
"CAS:5742-17-6",
"EF 3.1",
"https://commonchemistry.cas.org/detail?cas_rn=5742-17-6"
],
"prov:wasDerivedFrom": "common chemistry CAS lookup"
}
},
{
"@value": "Acetic acid, 2-(2,4-dichlorophenoxy)-, compd. with 2-propanamine (1:1)",
"@language": "en",
"@lang": "en",
"provenance": {
"prov:wasGeneratedBy": "consensus_match",
"prov:wasAttributedTo": "brightway-flows",
"prov:hadPrimarySource": [
"CAS:5742-17-6",
"EF 3.1",
"https://commonchemistry.cas.org/detail?cas_rn=5742-17-6"
],
"prov:wasDerivedFrom": "common chemistry CAS lookup"
}
},
{
"@value": "Isopropylamine, compd. with (2,4-dichlorophenoxy)acetic acid (1:1)",
"@language": "en",
"@lang": "en",
"provenance": {
"prov:wasGeneratedBy": "consensus_match",
"prov:wasAttributedTo": "brightway-flows",
"prov:hadPrimarySource": [
"CAS:5742-17-6",
"EF 3.1",
"https://commonchemistry.cas.org/detail?cas_rn=5742-17-6"
],
"prov:wasDerivedFrom": "common chemistry CAS lookup"
}
}
],
"properties": {
"https://w3id.org/chemrof/molecular_formula": {
"@id": "https://w3id.org/chemrof/molecular_formula",
"@value": [
"C11H15Cl2NO3"
],
"attested_by": {
"C11H15Cl2NO3": [
"enrich_references.pubchem_semantic",
"rdkit_post_consensus"
]
},
"rdfs:label": "Molecular formula",
"provenance": [
{
"prov:wasGeneratedBy": "enrich_references.pubchem_semantic",
"prov:wasAttributedTo": "brightway-flows",
"prov:hadPrimarySource": [
"CID:21965",
"CID:57358267"
],
"prov:wasDerivedFrom": "pubchem.props.Molecular Formula"
},
{
"prov:wasGeneratedBy": "rdkit_post_consensus",
"prov:wasAttributedTo": "brightway-flows",
"prov:hadPrimarySource": [
"CC(C)N.O=C(O)COc1ccc(Cl)cc1Cl"
]
}
]
},
"https://w3id.org/chemrof/inchi2d_key_string": {
"@id": "https://w3id.org/chemrof/inchi2d_key_string",
"@value": [
"HXMBBZAHRWCZOX-UHFFFAOYSA-N"
],
"attested_by": {
"HXMBBZAHRWCZOX-UHFFFAOYSA-N": [
"enrich_references.pubchem_semantic",
"rdkit_post_consensus"
]
},
"rdfs:label": "InChIKey",
"provenance": [
{
"prov:wasGeneratedBy": "enrich_references.pubchem_semantic",
"prov:wasAttributedTo": "brightway-flows",
"prov:hadPrimarySource": [
"CID:21965",
"CID:57358267"
],
"prov:wasDerivedFrom": "pubchem.props.InChIKey"
},
{
"prov:wasGeneratedBy": "rdkit_post_consensus",
"prov:wasAttributedTo": "brightway-flows",
"prov:hadPrimarySource": [
"CC(C)N.O=C(O)COc1ccc(Cl)cc1Cl"
]
}
]
},
"https://w3id.org/chemrof/smiles_string": {
"@id": "https://w3id.org/chemrof/smiles_string",
"rdfs:label": "SMILES",
"@value": [
"CC(C)N.O=C(O)COc1ccc(Cl)cc1Cl"
],
"provenance": [
{
"prov:wasGeneratedBy": "opsin_iupac",
"prov:wasAttributedTo": "brightway-flows",
"prov:hadPrimarySource": [
"(2,4-Dichlorophenoxy)acetic acid isopropylamine salt"
]
},
{
"prov:wasGeneratedBy": "rdkit_post_consensus",
"prov:wasAttributedTo": "brightway-flows",
"prov:hadPrimarySource": [
"CC(C)N.O=C(O)COc1ccc(Cl)cc1Cl"
]
}
],
"attested_by": {
"CC(C)N.O=C(O)COc1ccc(Cl)cc1Cl": [
"opsin_iupac",
"rdkit_post_consensus"
]
}
},
"https://w3id.org/chemrof/inchi2d_string": {
"@id": "https://w3id.org/chemrof/inchi2d_string",
"rdfs:label": "InChI",
"@value": [
"InChI=1S/C8H6Cl2O3.C3H9N/c9-5-1-2-7(6(10)3-5)13-4-8(11)12;1-3(2)4/h1-3H,4H2,(H,11,12);3H,4H2,1-2H3"
],
"provenance": [
{
"prov:wasGeneratedBy": "opsin_iupac",
"prov:wasAttributedTo": "brightway-flows",
"prov:hadPrimarySource": [
"(2,4-Dichlorophenoxy)acetic acid isopropylamine salt"
]
},
{
"prov:wasGeneratedBy": "rdkit_post_consensus",
"prov:wasAttributedTo": "brightway-flows",
"prov:hadPrimarySource": [
"CC(C)N.O=C(O)COc1ccc(Cl)cc1Cl"
]
}
],
"attested_by": {
"InChI=1S/C8H6Cl2O3.C3H9N/c9-5-1-2-7(6(10)3-5)13-4-8(11)12;1-3(2)4/h1-3H,4H2,(H,11,12);3H,4H2,1-2H3": [
"opsin_iupac",
"rdkit_post_consensus"
]
}
},
"https://w3id.org/chemrof/IUPAC_name": {
"@id": "https://w3id.org/chemrof/IUPAC_name",
"rdfs:label": "IUPAC name",
"@value": [
"(2,4-Dichlorophenoxy)acetic acid isopropylamine salt"
],
"provenance": {
"prov:wasGeneratedBy": "opsin_iupac",
"prov:wasAttributedTo": "brightway-flows",
"prov:hadPrimarySource": [
"(2,4-Dichlorophenoxy)acetic acid isopropylamine salt"
]
},
"attested_by": {
"(2,4-Dichlorophenoxy)acetic acid isopropylamine salt": [
"opsin_iupac"
]
}
},
"https://w3id.org/chemrof/molecular_mass": {
"@id": "https://w3id.org/chemrof/molecular_mass",
"rdfs:label": "Molecular mass",
"@value": [
280.151
],
"provenance": [
{
"prov:wasGeneratedBy": "rdkit_pre_consensus",
"prov:wasAttributedTo": "brightway-flows",
"prov:hadPrimarySource": [
"CC(C)N.C1=CC(=C(C=C1Cl)Cl)OCC(=O)O"
]
},
{
"prov:wasGeneratedBy": "rdkit_post_consensus",
"prov:wasAttributedTo": "brightway-flows",
"prov:hadPrimarySource": [
"CC(C)N.O=C(O)COc1ccc(Cl)cc1Cl"
]
}
],
"attested_by": {
"280.151": [
"rdkit_post_consensus",
"rdkit_pre_consensus"
]
},
"http://qudt.org/schema/qudt/hasUnit": "https://vocab.brightway.one/units/unit/GM-PER-MOL"
},
"https://w3id.org/chemrof/monoisotopic_mass": {
"@id": "https://w3id.org/chemrof/monoisotopic_mass",
"rdfs:label": "Monoisotopic mass",
"@value": [
279.042899
],
"provenance": [
{
"prov:wasGeneratedBy": "rdkit_pre_consensus",
"prov:wasAttributedTo": "brightway-flows",
"prov:hadPrimarySource": [
"CC(C)N.C1=CC(=C(C=C1Cl)Cl)OCC(=O)O"
]
},
{
"prov:wasGeneratedBy": "rdkit_post_consensus",
"prov:wasAttributedTo": "brightway-flows",
"prov:hadPrimarySource": [
"CC(C)N.O=C(O)COc1ccc(Cl)cc1Cl"
]
}
],
"attested_by": {
"279.042899": [
"rdkit_post_consensus",
"rdkit_pre_consensus"
]
},
"http://qudt.org/schema/qudt/hasUnit": "https://vocab.brightway.one/units/unit/GM-PER-MOL"
}
},
"references": [
{
"@id": "https://chem.echa.europa.eu/100.217.275",
"provenance": {
"prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
"prov:wasAttributedTo": "brightway-flows",
"prov:hadPrimarySource": [
"CID:21965;CAS:5742-17-6"
],
"prov:wasDerivedFrom": "pubchem.identifiers[5742-17-6]"
}
},
{
"@id": "https://commonchemistry.cas.org/detail?cas_rn=5742-17-6",
"provenance": {
"prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
"prov:wasAttributedTo": "brightway-flows",
"prov:hadPrimarySource": [
"CID:57358267;CAS:5742-17-6"
],
"prov:wasDerivedFrom": "pubchem.identifiers[5742-17-6]"
}
},
{
"@id": "https://comptox.epa.gov/dashboard/DTXSID8034241",
"provenance": {
"prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
"prov:wasAttributedTo": "brightway-flows",
"prov:hadPrimarySource": [
"CID:57358267;CAS:5742-17-6"
],
"prov:wasDerivedFrom": "pubchem.identifiers[5742-17-6]"
}
},
{
"@id": "https://gsrs.ncats.nih.gov/ginas/app/beta/substances/888X4O09G2",
"provenance": {
"prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
"prov:wasAttributedTo": "brightway-flows",
"prov:hadPrimarySource": [
"CID:57358267;CAS:5742-17-6"
],
"prov:wasDerivedFrom": "pubchem.identifiers[5742-17-6]"
}
},
{
"@id": "https://pubchem.ncbi.nlm.nih.gov/compound/21965",
"provenance": {
"prov:wasGeneratedBy": "enrich_references.pubchem_compound",
"prov:wasAttributedTo": "brightway-flows",
"prov:hadPrimarySource": [
"CID:21965;CAS:5742-17-6"
],
"prov:wasDerivedFrom": "pubchem.by_cas[5742-17-6]"
}
},
{
"@id": "https://pubchem.ncbi.nlm.nih.gov/compound/57358267",
"provenance": {
"prov:wasGeneratedBy": "enrich_references.pubchem_compound",
"prov:wasAttributedTo": "brightway-flows",
"prov:hadPrimarySource": [
"CID:57358267;CAS:5742-17-6"
],
"prov:wasDerivedFrom": "pubchem.by_cas[5742-17-6]"
}
},
{
"@id": "https://www.ebi.ac.uk/chembl/explore/compound/CHEMBL3561299",
"provenance": {
"prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
"prov:wasAttributedTo": "brightway-flows",
"prov:hadPrimarySource": [
"CID:57358267;CAS:5742-17-6"
],
"prov:wasDerivedFrom": "pubchem.identifiers[5742-17-6]"
}
},
{
"@id": "https://www.wikidata.org/wiki/Q27269908",
"provenance": {
"prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
"prov:wasAttributedTo": "brightway-flows",
"prov:hadPrimarySource": [
"CID:21965;CAS:5742-17-6"
],
"prov:wasDerivedFrom": "pubchem.identifiers[5742-17-6]"
}
}
],
"prefLabel": [
{
"@value": "2,4-dichlorophenoxyacetic Acid, Isoproplyamine Salt",
"@language": "en",
"@lang": "en",
"provenance": {
"prov:wasGeneratedBy": "bootstrap_labels",
"prov:wasAttributedTo": "brightway-flows",
"prov:hadPrimarySource": [
"EF 3.1"
],
"prov:wasDerivedFrom": "legacy name field"
}
}
],
"@type": [
"https://w3id.org/chemrof/MolecularComplex"
],
"http://www.w3.org/2004/02/skos/core#definition": [],
"uuid": "b07c6f0006fca906d70791ed09f3e264c46acda2",
"identifier": "",
"name": "2,4-dichlorophenoxyacetic Acid, Isoproplyamine Salt",
"source": "stepwise algorithm addition",
"cas_numbers": [
"5742-17-6"
],
"ec_numbers": [],
"context": {
"dimension": "Environmental",
"media": "Water",
"water_body": "Unconfined aquifer"
},
"synonyms": [],
"lcia_methods": [],
"unit": "kg",
"input_datasets": [],
"context_iri": "https://vocab.brightway.one/flow-contexts/envi-wate-unaq",
"unit_iri": "https://vocab.brightway.one/units/unit/KiloGM",
"flow_object_id": "fo-5f6ca937aa0e11e9",
"concept_associations": [
{
"@type": "xkos:ConceptAssociation",
"xkos:sourceConcept": {
"@id": "https://vocab.brightway.one/stepwise/2006-1.09/flow/a030e433-d020-58e7-a596-8d8ad902503b",
"skos:prefLabel": "2,4-D, Isopropylamine Salt",
"context": "Water / groundwater",
"qudt:hasUnit": {
"@id": "https://vocab.brightway.one/units/unit/KiloGM"
},
"skos:exactMatch": {
"@id": "https://vocab.brightway.dev/elementary-flows/b07c6f0006fca906d70791ed09f3e264c46acda2"
}
},
"xkos:targetConcept": {
"@id": "https://vocab.brightway.dev/elementary-flows/b07c6f0006fca906d70791ed09f3e264c46acda2"
},
"provenance": {
"prov:wasGeneratedBy": "merge_stepwise",
"prov:wasAttributedTo": "brightway-flows",
"prov:hadPrimarySource": [
"stepwise:2006-1.09:a030e433-d020-58e7-a596-8d8ad902503b",
"2,4-D, Isopropylamine Salt",
"",
"algorithm.lookup_order=cas>ec>label",
"algorithm.basis=cas:5742-17-6",
"algorithm.flow_object_candidates=1",
"algorithm.elementary_candidates=14",
"algorithm.selector_reason=new-elementary-flow-created",
"algorithm.score_rule=exact-iri-shortcircuit;up-tree-filter;score=(2*unit_exact)+context_overlap-context_penalty+context_iri_exact;contradiction-veto",
"algorithm.winning_score=3",
"algorithm.tie_on_top_score=true"
],
"prov:wasDerivedFrom": "algorithmic_fallback:lookup_order(cas>ec>label);basis(cas:5742-17-6);flow_object_candidates(1);elementary_candidates(14);selector(new-elementary-flow-created);exact-iri-shortcircuit;up-tree-filter;score=(2*unit_exact)+context_overlap-context_penalty+context_iri_exact;contradiction-veto"
}
}
],
"_sources": {},
"cas_match_labels": {},
"general_comment": "",
"_transformed": false,
"_provided": {
"name": null,
"synonyms": [],
"context": [],
"cas_numbers": [],
"ec_numbers": [],
"unit": null
},
"elementary_flow_id": "b07c6f0006fca906d70791ed09f3e264c46acda2"
}
Something wrong here?
A flow can be wrong in three ways, and they are decided differently. Pick the one that matches what you are looking at.
- A row from my list should not reach this flow
- This flow is not that chemical
- The compartment or the unit is wrong
- One of these characterisation factors cannot be this substance's
You do not need to run a build or clone anything. Name the row and say what your evidence is; the measurement is done for you. How contributing works