Oxathiapiprolin
fo-ddf397e8cf8c8a27
Identity
- Type
- Neutral molecule
- CAS
- 1003318-67-9
- EC
- 801-263-1
- Origin
- EF 3.1 hybrid_name_cas_v1
- Changes
- 58 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 |
|---|---|---|
| agrochemical CHEBI:33286 | An agrochemical is a substance that is used in agriculture or horticulture. | ChEBI |
| fungicide CHEBI:24127 | A substance used to destroy fungal 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
10- 1-(4-{4-[5-(2,6-difluorophenyl)-4,5-dihydro-1,2-oxazol-3-yl]-1,3-thiazol-2-yl}piperidin-1-yl)-2-[5-methyl-3-(trifluoromethyl)-1h-pyrazol-1-yl]ethan-1-one
- 1-[4-[4-[5-(2,6-Difluorophenyl)-4,5-dihydro-1,2-oxazol-3-yl]-1,3-thiazol-2-yl]piperidin-1-yl]-2-[5-methyl-3-(trifluoromethyl)-1H-pyrazol-1-yl]ethanone
- 1-[4-[4-[5-(2,6-Difluorophenyl)-4,5-dihydro-3-isoxazolyl]-2-thiazolyl]-1-piperidinyl]-2-[5-methyl-3-(trifluoromethyl)-1H-pyrazol-1-yl]ethanone
- DPX-QGU42
- Ethanone, 1-[4-[4-[5-(2,6-difluorophenyl)-4,5-dihydro-3-isoxazolyl]-2-thiazolyl]-1-piperidinyl]-2-[5-methyl-3-(trifluoromethyl)-1H-pyrazol-1-yl]-
- oxathiapiproline
- QGU42
- rac-1-(4-{4-[5-(2,6-difluorophenyl)-4,5-dihydro-1,2-oxazol-3-yl]-1,3-thiazol-2-yl}piperidin-1-yl)-2-[5-methyl-3-(trifluoromethyl)-1H-pyrazol-1-yl]ethanone
- Zelavin
- Zorvec
Properties
| Property | Value |
|---|---|
| Elemental charge chemrof:elemental_charge | 0 |
| InChI2D key string chemrof:inchi2d_key_string | IAQLCKZJGNTRDO-UHFFFAOYSA-N |
| InChI2D string chemrof:inchi2d_string | InChI=1S/C24H22F5N5O2S/c1-13-9-20(24(27,28)29)31-34(13)11-21(35)33-7-5-14(6-8-33)23-30-18(12-37-23)17-10-19(36-32-17)22-15(25)3-2-4-16(22)26/h2-4,9,12,14,19H,5-8,10-11H2,1H3 |
| IUPAC name chemrof:IUPAC_name | rac-1-(4-{4-[5-(2,6-difluorophenyl)-4,5-dihydro-1,2-oxazol-3-yl]-1,3-thiazol-2-yl}piperidin-1-yl)-2-[5-methyl-3-(trifluoromethyl)-1H-pyrazol-1-yl]ethanone |
| Molecular formula chemrof:molecular_formula | C24H22F5N5O2S |
| Molecular mass chemrof:molecular_mass | 539.521, 539.53 |
| Monoisotopic mass chemrof:monoisotopic_mass | 539.141437, 539.14144 |
| SMILES string chemrof:smiles_string | Cc1cc(C(F)(F)F)nn1CC(=O)N1CCC(c2nc(C3=NOC(c4c(F)cccc4F)C3)cs2)CC1 |
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=1003318-67-9 | enrich_references.chebi_xrefs |
| ChEBI | https://www.ebi.ac.uk/chebi/searchId.do?chebiId=CHEBI:83268 | enrich_references.chebi_id_link |
| ChEBI | https://www.ebi.ac.uk/chebi/searchId.do?chebiId=CHEBI:83271 | enrich_references.pubchem_identifier_url |
| chem.echa.europa.eu | https://chem.echa.europa.eu/100.227.885 | enrich_references.pubchem_identifier_url |
| comptox.epa.gov | https://comptox.epa.gov/dashboard/DTXSID30893604 | enrich_references.pubchem_identifier_url |
| gsrs.ncats.nih.gov | https://gsrs.ncats.nih.gov/ginas/app/beta/substances/56498AIV8R | enrich_references.pubchem_identifier_url |
| jglobal.jst.go.jp | http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J3.150.249G | enrich_references.pubchem_identifier_url |
| pesticides | pesticides:oxathiapiprolin | enrich_references.chebi_xrefs |
| PubChem | https://pubchem.ncbi.nlm.nih.gov/compound/56945145 | enrich_references.pubchem_compound |
| PubMed | https://pubmed.ncbi.nlm.nih.gov/24440097 | enrich_references.chebi_xrefs |
| reaxys | reaxys:20731698 | enrich_references.chebi_xrefs |
| Wikidata | https://www.wikidata.org/wiki/Q27156718 | enrich_references.pubchem_identifier_url |
| Wikipedia | https://en.wikipedia.org/wiki/Oxathiapiprolin | enrich_references.pubchem_identifier_url |
Elementary flows
14| Flow | Context | Source | Unit | CFs |
|---|---|---|---|---|
| 449271f2-6592-45da-8d9a-f1f5c33b9ca1 | Environmental → Air → Aircraft cruise height | EF 3.1 | kg | 4 |
| f0227c2f-7394-4d93-a7a8-9dfca248aae8 | Environmental → Air → Ground level → Urban (>1000 people/square mile) | EF 3.1 | kg | 4 |
| ccd7f129-80a9-4d35-bd82-d16ebc6a5ea4 | Environmental → Air → Indoor | EF 3.1 | kg | 4 |
| fb0bf5a8-5e3f-4681-8556-14667a46cf9e | Environmental → Air → Long-term | EF 3.1 | kg | 0 |
| 4f328cde-78f7-409c-a103-7f63684fa6c2 | Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) | EF 3.1 | kg | 4 |
| 2928108a-201b-49ae-902e-974bda314688 | Environmental → Air → Unknown | EF 3.1 | kg | 4 |
| 63b38c68-abc2-4fc3-8de9-371dbcc4d56a | Environmental → Ground → Agricultural | EF 3.1 | kg | 4 |
| e6ee9d91-5b47-41e7-9cf6-e34eb81801ed | Environmental → Ground → Non-agricultural | EF 3.1 | kg | 4 |
| 0a6aaac6974357b02e68ca5f482246a54cc89941 | Environmental → Ground → Silvicultural | ecoinvent algorithm addition | kg | 0 |
| c929f516-0cfb-44ed-8baf-30f652cb3bac | Environmental → Ground → Unknown | EF 3.1 | kg | 4 |
| 92bd8f0d-6550-4ab3-9d7f-6abf64697ffc | Environmental → Water → Long-term | EF 3.1 | kg | 0 |
| bbd272f0-0f14-4114-8ed3-a8bb48d6f885 | Environmental → Water → Ocean | EF 3.1 | kg | 4 |
| d6e3693f-bae1-4cdf-8f94-9e03e5c5ad55 | Environmental → Water → Surface water | EF 3.1 | kg | 4 |
| 0dddceaa-94a5-4cc5-975d-bce1907e38f7 | Environmental → Water → Unknown | EF 3.1 | kg | 4 |
History
Everything that changed this substance (58 changes)
Full record
Flow object JSON
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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