Pinoxaden

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
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

8-(2,6-diethyl-4-methylphenyl)-7-oxo-1,2,4,5-tetrahydro-7H-pyrazolo[1,2-d][1,4,5]oxadiazepin-9-yl 2,2-dimethylpropanoate
8-(2,6-diethyl-p-tolyl)-1,2,4,5-tetrahydro-7-oxo-7H-pyrazolo[1,2-d][1,4,5]oxadiazepin-9-yl 2,2-dimethylpropionate
NewAxial
Pinoxaden (iso); 8-(2,6-diethyl-4-methylphenyl)-7-oxo-1,2,4,5-tetrahydro-7h-pyrazolo[1,2-d][1,4,5]oxadiazepin-9-yl 2,2-dimethylpropanoate
Propanoic acid, 2,2-dimethyl-, 8-(2,6-diethyl-4-methylphenyl)-1,2,4,5-tetrahydro-7-oxo-7H-pyrazolo[1,2-d][1,4,5]oxadiazepin-9-yl ester

Property	Value
Elemental charge chemrof:elemental_charge	0
InChI2D key string chemrof:inchi2d_key_string	MGOHCFMYLBAPRN-UHFFFAOYSA-N
InChI2D string chemrof:inchi2d_string	InChI=1S/C23H32N2O4/c1-7-16-13-15(3)14-17(8-2)18(16)19-20(26)24-9-11-28-12-10-25(24)21(19)29-22(27)23(4,5)6/h13-14H,7-12H2,1-6H3
IUPAC name chemrof:IUPAC_name	8-(2,6-diethyl-4-methylphenyl)-7-oxo-1,2,4,5-tetrahydro-7H-pyrazolo[1,2-d][1,4,5]oxadiazepin-9-yl 2,2-dimethylpropanoate
Molecular formula chemrof:molecular_formula	C23H32N2O4
Molecular mass chemrof:molecular_mass	400.519
Monoisotopic mass chemrof:monoisotopic_mass	400.236208, 400.23621
SMILES string chemrof:smiles_string	CCc1cc(C)cc(CC)c1-c1c(OC(=O)C(C)(C)C)n2n(c1=O)CCOCC2

Where 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=243973-20-8	enrich_references.chebi_xrefs
ChEBI	https://www.ebi.ac.uk/chebi/searchId.do?chebiId=CHEBI:83524	enrich_references.chebi_id_link
chem.echa.europa.eu	https://chem.echa.europa.eu/100.163.258	enrich_references.pubchem_identifier_url
comptox.epa.gov	https://comptox.epa.gov/dashboard/DTXSID8034823	enrich_references.pubchem_identifier_url
ebi.ac.uk	https://www.ebi.ac.uk/chembl/explore/compound/CHEMBL1866631	enrich_references.pubchem_identifier_url
gsrs.ncats.nih.gov	https://gsrs.ncats.nih.gov/ginas/app/beta/substances/U55GLF9LV9	enrich_references.pubchem_identifier_url
jglobal.jst.go.jp	http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J2.581.534C	enrich_references.pubchem_identifier_url
metabolomicsworkbench.org	https://www.metabolomicsworkbench.org/data/StructureData.php?RegNo=143671	enrich_references.pubchem_identifier_url
pesticides	pesticides:pinoxaden	enrich_references.chebi_xrefs
ppdb	ppdb:528	enrich_references.chebi_xrefs
PubChem	https://pubchem.ncbi.nlm.nih.gov/compound/210326	enrich_references.pubchem_compound
PubMed	https://pubmed.ncbi.nlm.nih.gov/24485310	enrich_references.chebi_xrefs
PubMed	https://pubmed.ncbi.nlm.nih.gov/24759052	enrich_references.chebi_xrefs
PubMed	https://pubmed.ncbi.nlm.nih.gov/26449612	enrich_references.chebi_xrefs
reaxys	reaxys:11330254	enrich_references.chebi_xrefs
wikidata.org	https://www.wikidata.org/wiki/Q15632855	enrich_references.pubchem_identifier_url
Wikipedia	https://en.wikipedia.org/wiki/Pinoxaden	enrich_references.pubchem_identifier_url

Flow	Context	Source	Unit	CFs
99f70849-0465-493b-86f1-fd6fbf4342e9	Environmental → Air → Aircraft cruise height	EF 3.1	kg	4
a9c58127-2954-4cb7-b12c-b1dfe45707df	Environmental → Air → Ground level → Urban (>1000 people/square mile)	EF 3.1	kg	4
a27425b8-46a5-47dd-aeac-f7ef74e1e2ed	Environmental → Air → Indoor	EF 3.1	kg	4
fd0a4b04-e083-4367-899c-a771bacf7fa1	Environmental → Air → Long-term	EF 3.1	kg	0
48946628-fbad-45f8-bea6-06b09b0d8090	Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile)	EF 3.1	kg	4
7e0b1145-4f49-453a-97fd-7796fd5808e2	Environmental → Air → Unknown	EF 3.1	kg	4
fc3f8e68-3f7b-4cd3-a392-d154cb5dcb3a	Environmental → Ground → Agricultural	EF 3.1	kg	4
4e52a4e0-4520-44f5-96ec-1564aa0dbf57	Environmental → Ground → Non-agricultural	EF 3.1	kg	4
0e5f0211b3a38aee9b4bc2190a8e4ccab9f4570f	Environmental → Ground → Silvicultural	ecoinvent algorithm addition	kg	0
c1174d5e-782a-417a-8e15-12f34b6a28c4	Environmental → Ground → Unknown	EF 3.1	kg	4
27cf54ce-29fe-4b97-a6b7-3b5dc6bca533	Environmental → Water → Long-term	EF 3.1	kg	0
fbe5476e-43d1-4e26-b637-3ccd5cb254d5	Environmental → Water → Ocean	EF 3.1	kg	4
2482361e-fa62-400e-bd07-5ab012891547	Environmental → Water → Surface water	EF 3.1	kg	4
3a490136-36ab-4e33-8ee3-099dcbe95c79	Environmental → Water → Unknown	EF 3.1	kg	4

Everything that changed this substance (59 changes)

Open the changes page

Flow object JSON

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Pinoxaden

Identity

Structure

What it is used for

Alternative labels

Properties

Known URLs

Elementary flows

History

Full record

Keyboard