Paraquat
fo-d5e5a11080bed5ec
Identity
- Type
- Molecular cation
- CAS
- 4685-14-7
- EC
- 225-141-7
- Origin
- EF 3.1 hybrid_name_cas_v1
- Changes
- 59 across every transformer
Structure
What it is used for
2
Roles, not types. A substance bears as many as apply — sulfluramid is an
insecticide and an acaricide — and each is a class ChEBI curates, asserted
with ChEBI’s own has role. The narrow ones publish the broad
ones alongside them, so a substance filed as a herbicide is a pesticide
here too. See agricultural
chemicals for what the axis is and which classes are published.
| Role | Definition | Evidence |
|---|---|---|
| herbicide CHEBI:24527 | A substance used to destroy plant pests. | ChEBI |
| pesticide CHEBI:25944 | Strictly, a substance intended to kill pests. In common usage, any substance used for controlling, preventing, or destroying animal, microbiological or plant pests. | ChEBI |
Alternative labels
20- 1,1'-dimethyl-4,4'-bipyridinium
- 1,1'-dimethyl-4,4'-bipyridyldiylium
- 1,1'-dimethyl-[4,4'-bipyridin]-1,1'-diium
- 1,1′-Dimethyl-4,4′-bipyridinium
- 1,1′-Dimethyl-4,4′-bipyridinium cation
- 1-Methyl-4-(1-methylpyridin-1-ium-4-yl)pyridin-1-ium
- 4,4′-Bipyridinium, 1,1′-dimethyl-
- dimethyl viologen
- MeSH ID: D010269
- Methyl viologen dication
- methyl viologen ion(2+)
- Methyl viologen(2+)
- N,N'-dimethyl-4,4'-bipyridinium
- N,N'-dimethyl-4,4'-bipyridinium dication
- N,N′-Dimethyl-4,4′-bipyridinium
- N,N′-Dimethyl-4,4′-bipyridinium dication
- paraquat dication
- paraquat ion
- Spraytop-graze
- Starfire
Properties
| Property | Value |
|---|---|
| Elemental charge chemrof:elemental_charge | 2 |
| InChI2D key string chemrof:inchi2d_key_string | INFDPOAKFNIJBF-UHFFFAOYSA-N |
| InChI2D string chemrof:inchi2d_string | InChI=1S/C12H14N2/c1-13-7-3-11(4-8-13)12-5-9-14(2)10-6-12/h3-10H,1-2H3/q+2 |
| IUPAC name chemrof:IUPAC_name | 1,1'-dimethyl-[4,4'-bipyridin]-1,1'-diium |
| Molecular formula chemrof:molecular_formula | C12H14N2, C12H14N2+2 |
| Molecular mass chemrof:molecular_mass | 186.258 |
| Monoisotopic mass chemrof:monoisotopic_mass | 186.1146, 186.114601 |
| SMILES string chemrof:smiles_string | C[n+]1ccc(-c2cc[n+](C)cc2)cc1 |
Known URLs
38Where else this substance is described. Collected while the pipeline resolved it — from ChEBI's cross-references, from PubChem's identifier list, and from the CAS number — so a link here is a record the merge actually read, not a search it suggests.
| Resource | URL | Recorded by |
|---|---|---|
| CAS Common Chemistry | https://commonchemistry.cas.org/detail?cas_rn=4685-14-7 | enrich_references.chebi_xrefs |
| ChEBI | https://www.ebi.ac.uk/chebi/searchId.do?chebiId=CHEBI:34905 | enrich_references.chebi_id_link |
| chem.echa.europa.eu | https://chem.echa.europa.eu/100.022.855 | enrich_references.pubchem_identifier_url |
| ChemSpider | https://www.chemspider.com/Chemical-Structure.15147.html | enrich_references.chebi_xrefs |
| comptox.epa.gov | https://comptox.epa.gov/dashboard/DTXSID3034799 | enrich_references.pubchem_identifier_url |
| ebi.ac.uk | https://www.ebi.ac.uk/chembl/explore/compound/CHEMBL74469 | enrich_references.pubchem_identifier_url |
| foodb.food | foodb.food:FDB011120 | enrich_references.chebi_xrefs |
| gmelin | gmelin:51125 | enrich_references.chebi_xrefs |
| gsrs.ncats.nih.gov | https://gsrs.ncats.nih.gov/ginas/app/beta/substances/PLG39H7695 | enrich_references.pubchem_identifier_url |
| jglobal.jst.go.jp | http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J913J | enrich_references.pubchem_identifier_url |
| KEGG | https://www.genome.jp/entry/C14701 | enrich_references.chebi_xrefs |
| kegg.jp | https://www.kegg.jp/entry/C14701 | enrich_references.pubchem_identifier_url |
| metabolomicsworkbench.org | https://www.metabolomicsworkbench.org/data/StructureData.php?RegNo=45895 | enrich_references.pubchem_identifier_url |
| pesticides | pesticides:paraquat | enrich_references.chebi_xrefs |
| ppdb | ppdb:505 | enrich_references.chebi_xrefs |
| PubChem | https://pubchem.ncbi.nlm.nih.gov/compound/15939 | enrich_references.pubchem_compound |
| PubChem | https://pubchem.ncbi.nlm.nih.gov/substance/?source=niaid&sourceid=503270 | enrich_references.pubchem_identifier_url |
| PubMed | https://pubmed.ncbi.nlm.nih.gov/11349957 | enrich_references.chebi_xrefs |
| PubMed | https://pubmed.ncbi.nlm.nih.gov/18620719 | enrich_references.chebi_xrefs |
| PubMed | https://pubmed.ncbi.nlm.nih.gov/20377249 | enrich_references.chebi_xrefs |
| PubMed | https://pubmed.ncbi.nlm.nih.gov/20582739 | enrich_references.chebi_xrefs |
| PubMed | https://pubmed.ncbi.nlm.nih.gov/21151885 | enrich_references.chebi_xrefs |
| PubMed | https://pubmed.ncbi.nlm.nih.gov/21236547 | enrich_references.chebi_xrefs |
| PubMed | https://pubmed.ncbi.nlm.nih.gov/21300143 | enrich_references.chebi_xrefs |
| PubMed | https://pubmed.ncbi.nlm.nih.gov/21318114 | enrich_references.chebi_xrefs |
| PubMed | https://pubmed.ncbi.nlm.nih.gov/21429624 | enrich_references.chebi_xrefs |
| PubMed | https://pubmed.ncbi.nlm.nih.gov/21493003 | enrich_references.chebi_xrefs |
| PubMed | https://pubmed.ncbi.nlm.nih.gov/21598522 | enrich_references.chebi_xrefs |
| PubMed | https://pubmed.ncbi.nlm.nih.gov/21616728 | enrich_references.chebi_xrefs |
| PubMed | https://pubmed.ncbi.nlm.nih.gov/21619794 | enrich_references.chebi_xrefs |
| PubMed | https://pubmed.ncbi.nlm.nih.gov/21619822 | enrich_references.chebi_xrefs |
| PubMed | https://pubmed.ncbi.nlm.nih.gov/21750730 | enrich_references.chebi_xrefs |
| PubMed | https://pubmed.ncbi.nlm.nih.gov/21777615 | enrich_references.chebi_xrefs |
| PubMed | https://pubmed.ncbi.nlm.nih.gov/21787677 | enrich_references.chebi_xrefs |
| PubMed | https://pubmed.ncbi.nlm.nih.gov/21802509 | enrich_references.chebi_xrefs |
| reaxys | reaxys:3590305 | enrich_references.chebi_xrefs |
| Wikidata | https://www.wikidata.org/wiki/Q26841324 | enrich_references.pubchem_identifier_url |
| Wikipedia | https://en.wikipedia.org/wiki/Paraquat | enrich_references.pubchem_identifier_url |
Elementary flows
16| Flow | Context | Source | Unit | CFs |
|---|---|---|---|---|
| 986205ff-a062-4d2b-8263-8ea7d0478948 | Environmental → Air → Aircraft cruise height | EF 3.1 | kg | 4 |
| b0019a26-8c37-4e8e-acea-71b066d9c19a | Environmental → Air → Ground level → Urban (>1000 people/square mile) | EF 3.1 | kg | 4 |
| 4071b67b-cb2e-4cc0-abc9-80834db5b1fc | Environmental → Air → Indoor | EF 3.1 | kg | 4 |
| 044f905a-380c-4341-849a-5d25a137edbb | Environmental → Air → Long-term | EF 3.1 | kg | 0 |
| 11936eb8-1423-4d79-adab-280cb918aa4d | Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) | EF 3.1 | kg | 4 |
| 29f91915-f685-4315-9f01-5a86385d5a73 | Environmental → Air → Unknown | EF 3.1 | kg | 4 |
| e1baa14e-3363-4e99-91cb-a93aa8d295a7 | Environmental → Ground → Agricultural | EF 3.1 | kg | 4 |
| fc80104d-47e2-40ad-8d04-7eccd4121c25 | Environmental → Ground → Non-agricultural | EF 3.1 | kg | 4 |
| 8fea731547b705358a7141489fe92b68614a33ae | Environmental → Ground → Silvicultural | ecoinvent algorithm addition | kg | 0 |
| 0131c82e-8971-439f-bf4d-3b2ab971b69f | Environmental → Ground → Unknown | EF 3.1 | kg | 4 |
| f14cacf4-ea42-4c57-bdbf-741458d6e485 | Environmental → Water → Long-term | EF 3.1 | kg | 0 |
| 847b3ddd-fdc2-41c0-b337-c1c1ff7edbd5 | Environmental → Water → Ocean | EF 3.1 | kg | 4 |
| 0b7193be0218cbec3018581070cb7294ffd08c88 | Environmental → Water → River | agribalyse algorithm addition | kg | 0 |
| fafd0232-2d04-483c-b8f4-0d8f76badb6d | Environmental → Water → Surface water | EF 3.1 | kg | 4 |
| 5d4167c8cc1848fc56e6e7f260fff278167f85be | Environmental → Water → Unconfined aquifer | stepwise algorithm addition | kg | 0 |
| 85c53554-6efb-4fcb-b9de-8b15f2c27da5 | Environmental → Water → Unknown | EF 3.1 | kg | 4 |
History
Everything that changed this substance (59 changes)
Full record
Flow object JSON
{
"flow_object_id": "fo-d5e5a11080bed5ec",
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{
"@value": "Paraquat",
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{
"@value": "paraquat dication",
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{
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},
{
"@value": "Starfire",
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}Something wrong here?
- This substance is published under the wrong name
- This is not that chemical
- This record is two substances, or it is a second copy of one
You do not need to run a build or clone anything. Name the record and say what your evidence is; the measurement is done for you. How contributing works