Mecoprop
fo-f967a68639f45d28
Identity
- Type
- Neutral molecule
- CAS
- 93-65-2
- EC
- 202-264-4
- Origin
- EF 3.1 hybrid_name_cas_v1
- Changes
- 55 across every transformer
Structure
What it is used for
3
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 |
|---|---|---|
| environmental contaminant CHEBI:78298 | Any minor or unwanted substance introduced into the environment that can have undesired effects. | ChEBI |
| 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
7- (RS)-mecoprop
- 2-(4-Chloro-2-tolyloxy)propionic acid
- 2-(p-Chloro-o-tolyloxy)propionic acid
- 4-Chloro-2-methylphenoxy-alpha-propionic acid
- O-(4-chloro-2-methylphenyl)lactic acid
- rac-2-(4-chloro-2-methylphenoxy)propanoic acid
- racemic mecoprop
Properties
| Property | Value |
|---|---|
| Elemental charge chemrof:elemental_charge | 0 |
| InChI2D key string chemrof:inchi2d_key_string | WNTGYJSOUMFZEP-UHFFFAOYSA-N |
| InChI2D string chemrof:inchi2d_string | InChI=1S/C10H11ClO3/c1-6-5-8(11)3-4-9(6)14-7(2)10(12)13/h3-5,7H,1-2H3,(H,12,13) |
| IUPAC name chemrof:IUPAC_name | 2-(4-Chloro-2-tolyloxy)propionic acid |
| Molecular formula chemrof:molecular_formula | C10H11ClO3 |
| Molecular mass chemrof:molecular_mass | 214.646, 214.648 |
| Monoisotopic mass chemrof:monoisotopic_mass | 214.03967, 214.039672 |
| SMILES string chemrof:smiles_string | Cc1cc(Cl)ccc1OC(C)C(=O)O |
Known URLs
13Where 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=93-65-2 | enrich_references.chebi_xrefs |
| ChEBI | https://www.ebi.ac.uk/chebi/searchId.do?chebiId=CHEBI:75704 | enrich_references.chebi_id_link |
| ChEBI | https://www.ebi.ac.uk/chebi/searchId.do?chebiId=CHEBI:75711 | enrich_references.chebi_id_link |
| KEGG | https://www.genome.jp/entry/C18742 | enrich_references.chebi_xrefs |
| pesticides | pesticides:mecoprop | enrich_references.chebi_xrefs |
| ppdb | ppdb:430 | enrich_references.chebi_xrefs |
| PubMed | https://pubmed.ncbi.nlm.nih.gov/19962221 | enrich_references.chebi_xrefs |
| PubMed | https://pubmed.ncbi.nlm.nih.gov/21972828 | enrich_references.chebi_xrefs |
| PubMed | https://pubmed.ncbi.nlm.nih.gov/23312320 | enrich_references.chebi_xrefs |
| PubMed | https://pubmed.ncbi.nlm.nih.gov/23361178 | enrich_references.chebi_xrefs |
| PubMed | https://pubmed.ncbi.nlm.nih.gov/23422308 | enrich_references.chebi_xrefs |
| reaxys | reaxys:2212752 | enrich_references.chebi_xrefs |
| Wikipedia | https://en.wikipedia.org/wiki/Mecoprop | enrich_references.chebi_xrefs |
Elementary flows
15| Flow | Context | Source | Unit | CFs |
|---|---|---|---|---|
| 1869f676-53ad-4251-a3a4-414dffc81380 | Environmental → Air → Aircraft cruise height | EF 3.1 | kg | 4 |
| 315c5aa1-a9cc-4686-87ae-b038afb6fa28 | Environmental → Air → Ground level → Urban (>1000 people/square mile) | EF 3.1 | kg | 4 |
| 9aca37a3-b238-4e8b-9a56-85da0c254235 | Environmental → Air → Indoor | EF 3.1 | kg | 4 |
| e20148a5-4a3e-49a8-bba1-24b9d0851648 | Environmental → Air → Long-term | EF 3.1 | kg | 0 |
| 455fbc26-1ce3-44d6-97c0-029e2751b5dc | Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) | EF 3.1 | kg | 4 |
| d81e4b3a-f283-48e7-84e9-f99301527f85 | Environmental → Air → Unknown | EF 3.1 | kg | 4 |
| 232e8031-e545-4d16-8812-35d9dd38fd1a | Environmental → Ground → Agricultural | EF 3.1 | kg | 4 |
| a8576beb-04a5-4979-8d51-4c8dbeab86dd | Environmental → Ground → Non-agricultural | EF 3.1 | kg | 4 |
| 3a1498c685e20f0d31204f5b002bfd5dfd88f24e | Environmental → Ground → Silvicultural | ecoinvent algorithm addition | kg | 0 |
| 3537f7a9-8f74-4c7e-b7e5-1cef662fea85 | Environmental → Ground → Unknown | EF 3.1 | kg | 4 |
| e08bac31-6466-4eca-9039-aae565067552 | Environmental → Water → Long-term | EF 3.1 | kg | 0 |
| bf1fd9cc-e3a0-4440-9d53-2764a4ffe253 | Environmental → Water → Ocean | EF 3.1 | kg | 4 |
| c68f10dc-a9d7-4e17-85e2-cb1c0485e6f9 | Environmental → Water → Surface water | EF 3.1 | kg | 4 |
| addc48e38898c54bfd55bfb8ab6aada80a4a3956 | Environmental → Water → Unconfined aquifer | stepwise algorithm addition | kg | 0 |
| 730fd192-4a02-49ea-8796-9fb115b5e0bc | Environmental → Water → Unknown | EF 3.1 | kg | 4 |
History
Everything that changed this substance (55 changes)
Full record
Flow object JSON
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],
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],
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"202-264-4"
],
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"parent_intervention_id": null,
"http://www.w3.org/2004/02/skos/core#definition": [
{
"@value": "A monocarboxylic acid that is lactic acid in which the hydroxyl hydrogen is replaced by a 4-chloro-2-methylphenyl group.",
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{
"@value": "A racemate comprising equimolar amounts of (R)- and (S)-mecoprop.",
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],
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],
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{
"@id": "http://purl.obolibrary.org/obo/CHEBI_78298",
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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