Consensus flow list

Identity

Type
NeutralMolecule
CAS
101463-69-8
EC
417-680-3
Origin
EF 3.1 hybrid_name_cas_v1
Changes
58 across every transformer

Structure

Structure diagram for Flufenoxuron

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
acaricide CHEBI:22153 A substance used to destroy pests of the subclass Acari (mites and ticks). ChEBI
insecticide CHEBI:24852 Strictly, a substance intended to kill members of the class Insecta. In common usage, any substance used for preventing, destroying, repelling or controlling insects. 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

8

Properties

PropertyValue
Elemental charge chemrof:elemental_charge 0
InChI2D key string chemrof:inchi2d_key_string RYLHNOVXKPXDIP-UHFFFAOYSA-N
InChI2D string chemrof:inchi2d_string InChI=1S/C21H11ClF6N2O3/c22-12-8-10(21(26,27)28)4-7-17(12)33-11-5-6-16(15(25)9-11)29-20(32)30-19(31)18-13(23)2-1-3-14(18)24/h1-9H,(H2,29,30,31,32)
IUPAC name chemrof:IUPAC_name N-(((4-(2-chloro-4-(trifluoromethyl)phenoxy)-2-fluorophenyl)amino)carbonyl)-2,6-difluorobenzamide
Molecular formula chemrof:molecular_formula C21H11ClF6N2O3
Molecular mass chemrof:molecular_mass 488.771
Monoisotopic mass chemrof:monoisotopic_mass 488.036239, 488.03624
SMILES string chemrof:smiles_string O=C(NC(=O)c1c(F)cccc1F)Nc1ccc(Oc2ccc(C(F)(F)F)cc2Cl)cc1F

Known URLs

18

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
beilstein beilstein:8398323 enrich_references.chebi_xrefs
CAS Common Chemistry https://commonchemistry.cas.org/detail?cas_rn=101463-69-8 enrich_references.chebi_xrefs
ChEBI https://www.ebi.ac.uk/chebi/searchId.do?chebiId=CHEBI:39382 enrich_references.chebi_id_link
chem.echa.europa.eu https://chem.echa.europa.eu/100.101.654 enrich_references.pubchem_identifier_url
comptox.epa.gov https://comptox.epa.gov/dashboard/DTXSID1041978 enrich_references.pubchem_identifier_url
drugbank.ca https://www.drugbank.ca/drugs/DB15006 enrich_references.pubchem_identifier_url
ebi.ac.uk https://www.ebi.ac.uk/chembl/explore/compound/CHEMBL2287680 enrich_references.pubchem_identifier_url
gsrs.ncats.nih.gov https://gsrs.ncats.nih.gov/ginas/app/beta/substances/OD068OSS0N enrich_references.pubchem_identifier_url
HMDB https://hmdb.ca/metabolites/HMDB0252332 enrich_references.pubchem_identifier_url
jglobal.jst.go.jp http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J228.145G enrich_references.pubchem_identifier_url
KEGG https://www.genome.jp/entry/C18430 enrich_references.chebi_xrefs
kegg.jp https://www.kegg.jp/entry/C18430 enrich_references.pubchem_identifier_url
metabolomicsworkbench.org https://www.metabolomicsworkbench.org/data/StructureData.php?RegNo=56274 enrich_references.pubchem_identifier_url
patent patent:US4698365 enrich_references.chebi_xrefs
ppdb ppdb:332 enrich_references.chebi_xrefs
PubChem https://pubchem.ncbi.nlm.nih.gov/compound/91766 enrich_references.pubchem_compound
wikidata.org https://www.wikidata.org/wiki/Q2787491 enrich_references.pubchem_identifier_url
Wikipedia https://en.wikipedia.org/wiki/Flufenoxuron enrich_references.pubchem_identifier_url

Elementary flows

14
Flow Context Source Unit CFs
32b74d75-b546-41ad-8122-3ab973e728b6 Environmental → Air → Aircraft cruise height EF 3.1 kg 4
bd8e6700-4deb-4e89-ae03-75f54bd7e761 Environmental → Air → Ground level → Urban (>1000 people/square mile) EF 3.1 kg 4
96844828-80c8-4afa-b92d-aa8f7a36f281 Environmental → Air → Indoor EF 3.1 kg 4
9ad8345c-03a3-4511-b768-1b9506ea9d0a Environmental → Air → Long-term EF 3.1 kg 0
77228398-352e-4b28-9e0f-34470818bdbd Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) EF 3.1 kg 4
5d35b3d7-5953-4b42-82ec-1c85b5a5bce2 Environmental → Air → Unknown EF 3.1 kg 4
3a2ea261-4568-4be8-b35d-3ac3b05fa135 Environmental → Ground → Agricultural EF 3.1 kg 4
3bb0f4fd-e932-4b61-b9c1-f684c868ff88 Environmental → Ground → Non-agricultural EF 3.1 kg 4
1a8e3c43929c25d95e70880a141123beda758a71 Environmental → Ground → Silvicultural ecoinvent algorithm addition kg 0
e04ed85e-5370-4939-be66-4546396fd292 Environmental → Ground → Unknown EF 3.1 kg 4
188022a8-1ffe-4e24-ad8d-ca6de6694483 Environmental → Water → Long-term EF 3.1 kg 0
695e2d10-67e3-4f2e-9cfb-5d41415d4f21 Environmental → Water → Ocean EF 3.1 kg 4
f7cc159a-6240-4dec-8ebd-5567bed9d3f9 Environmental → Water → Surface water EF 3.1 kg 4
653496ae-fe83-4305-b3f1-8986c7323ca9 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-76bbfde9e752f3c5",
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    {
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  ],
  "altLabel": [
    {
      "@value": "1-(4-(2-cloro-α,α,α-p-trifluorotolyloxy)-2-fluorophenyl)-3-(2,6-difluorobenzolyl)urea",
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    },
    {
      "@value": "Benzamide, N-[[[4-[2-chloro-4-(trifluoromethyl)phenoxy]-2-fluorophenyl]amino]carbonyl]-2,6-difluoro-",
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