Consensus flow list

Identity

Type
NeutralMolecule
CAS
658066-35-4
EC
619-797-7
Origin
EF 3.1 hybrid_name_cas_v1
Changes
58 across every transformer

Structure

Structure diagram for Fluopyram

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

Properties

PropertyValue
Elemental charge chemrof:elemental_charge 0
InChI2D key string chemrof:inchi2d_key_string KVDJTXBXMWJJEF-UHFFFAOYSA-N
InChI2D string chemrof:inchi2d_string InChI=1S/C16H11ClF6N2O/c17-12-7-9(15(18,19)20)8-25-13(12)5-6-24-14(26)10-3-1-2-4-11(10)16(21,22)23/h1-4,7-8H,5-6H2,(H,24,26)
IUPAC name chemrof:IUPAC_name N-{2-(3-chloro-5-(trifluoromethyl)-2-pyridyl)ethyl}-alpha,alpha,alpha-trifluoro-o-toluamide
Molecular formula chemrof:molecular_formula C16H11ClF6N2O
Molecular mass chemrof:molecular_mass 396.718
Monoisotopic mass chemrof:monoisotopic_mass 396.04641
SMILES string chemrof:smiles_string O=C(NCCc1ncc(C(F)(F)F)cc1Cl)c1ccccc1C(F)(F)F

Known URLs

26

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=658066-35-4 enrich_references.chebi_xrefs
ChEBI https://www.ebi.ac.uk/chebi/searchId.do?chebiId=CHEBI:83070 enrich_references.chebi_id_link
chem.echa.europa.eu https://chem.echa.europa.eu/100.127.749 enrich_references.pubchem_identifier_url
comptox.epa.gov https://comptox.epa.gov/dashboard/DTXSID9058151 enrich_references.pubchem_identifier_url
ebi.ac.uk https://www.ebi.ac.uk/chembl/explore/compound/CHEMBL2286755 enrich_references.pubchem_identifier_url
gsrs.ncats.nih.gov https://gsrs.ncats.nih.gov/ginas/app/beta/substances/F0VT7K5302 enrich_references.pubchem_identifier_url
jglobal.jst.go.jp http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J2.854.782J enrich_references.pubchem_identifier_url
patent patent:EP2405752 enrich_references.chebi_xrefs
patent patent:EP2408301 enrich_references.chebi_xrefs
patent patent:US2011319432 enrich_references.chebi_xrefs
patent patent:US2012010253 enrich_references.chebi_xrefs
patent patent:WO2010102964 enrich_references.chebi_xrefs
patent patent:WO2010106008 enrich_references.chebi_xrefs
pesticides pesticides:fluopyram enrich_references.chebi_xrefs
ppdb ppdb:1362 enrich_references.chebi_xrefs
PubChem https://pubchem.ncbi.nlm.nih.gov/compound/11158353 enrich_references.pubchem_compound
PubMed https://pubmed.ncbi.nlm.nih.gov/21394880 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/22076736 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/22262495 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/23175430 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/24168041 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/24481672 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/25105487 enrich_references.chebi_xrefs
reaxys reaxys:11323270 enrich_references.chebi_xrefs
wikidata.org https://www.wikidata.org/wiki/Q15632704 enrich_references.pubchem_identifier_url
Wikipedia https://en.wikipedia.org/wiki/Fluopyram enrich_references.pubchem_identifier_url

Elementary flows

14
Flow Context Source Unit CFs
6202dee8-89a7-410f-a3e9-ca2b3178c435 Environmental → Air → Aircraft cruise height EF 3.1 kg 4
29b5e882-049a-47da-9a37-f48994943dec Environmental → Air → Ground level → Urban (>1000 people/square mile) EF 3.1 kg 4
2594e159-02cd-4ee0-a0aa-44ef9063bccf Environmental → Air → Indoor EF 3.1 kg 4
0924c2ce-b585-4bd3-8ee6-4159fe94ba65 Environmental → Air → Long-term EF 3.1 kg 0
fff50a2f-fb37-4e3d-bf8e-7639483585dd Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) EF 3.1 kg 4
b8001ce8-49c6-462a-94d6-ad1cd86a4072 Environmental → Air → Unknown EF 3.1 kg 4
e6286152-1a7a-4033-bd47-16915abec5dc Environmental → Ground → Agricultural EF 3.1 kg 4
061c4cbd-3259-470b-95ab-176c6b25a231 Environmental → Ground → Non-agricultural EF 3.1 kg 4
674d654d278945e0ff021c1dbb057f88a4b9ec19 Environmental → Ground → Silvicultural ecoinvent algorithm addition kg 0
9a7f5068-ee93-46bd-88b1-40ebd40c8de1 Environmental → Ground → Unknown EF 3.1 kg 4
fdf869d5-4917-4dbd-919f-061bbb1c45fe Environmental → Water → Long-term EF 3.1 kg 0
90465f13-1c2e-4910-bd90-5e4ee383655d Environmental → Water → Ocean EF 3.1 kg 4
705fe98c-30f8-443f-b3da-259f42965cb3 Environmental → Water → Surface water EF 3.1 kg 4
2d230c7a-1a0f-4566-81f3-f474e9bee246 Environmental → Water → Unknown EF 3.1 kg 4

History

Everything that changed this substance (58 changes)

Open the changes page

Full record

Flow object JSON
{
  "flow_object_id": "fo-89c103e3a1e71b47",
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  "altLabel": [
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      "@value": "Benzamide, N-[2-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]ethyl]-2-(trifluoromethyl)-",
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