Consensus flow list

Identity

Type
NeutralMolecule
CAS
272451-65-7
EC
608-064-7
Origin
EF 3.1 hybrid_name_cas_v1
Changes
58 across every transformer

Structure

Structure diagram for Flubendiamide

What it is used for

2

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
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

15

Properties

PropertyValue
Elemental charge chemrof:elemental_charge 0
InChI2D key string chemrof:inchi2d_key_string ZGNITFSDLCMLGI-UHFFFAOYSA-N
InChI2D string chemrof:inchi2d_string InChI=1S/C23H22F7IN2O4S/c1-12-10-13(21(24,22(25,26)27)23(28,29)30)8-9-16(12)32-18(34)14-6-5-7-15(31)17(14)19(35)33-20(2,3)11-38(4,36)37/h5-10H,11H2,1-4H3,(H,32,34)(H,33,35)
IUPAC name chemrof:IUPAC_name N(2)-[1,1-dimethyl-2-(methylsulfonyl)ethyl]-3-iodo-N(1)-{2-methyl-4-[1,2,2,2-tetrafluoro-1-(trifluoromethyl)ethyl]phenyl}benzene-1,2-dicarboxamide
Molecular formula chemrof:molecular_formula C23H22F7IN2O4S
Molecular mass chemrof:molecular_mass 682.396
Monoisotopic mass chemrof:monoisotopic_mass 682.02332, 682.023324
SMILES string chemrof:smiles_string Cc1cc(C(F)(C(F)(F)F)C(F)(F)F)ccc1NC(=O)c1cccc(I)c1C(=O)NC(C)(C)CS(C)(=O)=O

Known URLs

16

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=272451-65-7 enrich_references.chebi_xrefs
ChEBI https://www.ebi.ac.uk/chebi/searchId.do?chebiId=CHEBI:38798 enrich_references.chebi_id_link
chem.echa.europa.eu https://chem.echa.europa.eu/100.104.707 enrich_references.pubchem_identifier_url
chem.echa.europa.eu https://chem.echa.europa.eu/100.130.778 enrich_references.pubchem_identifier_url
comptox.epa.gov https://comptox.epa.gov/dashboard/DTXSID4047672 enrich_references.pubchem_identifier_url
ebi.ac.uk https://www.ebi.ac.uk/chembl/explore/compound/CHEMBL563789 enrich_references.pubchem_identifier_url
gsrs.ncats.nih.gov https://gsrs.ncats.nih.gov/ginas/app/beta/substances/GEV84ZI4K6 enrich_references.pubchem_identifier_url
HMDB https://hmdb.ca/metabolites/HMDB0252325 enrich_references.pubchem_identifier_url
jglobal.jst.go.jp http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J2.180.104F enrich_references.pubchem_identifier_url
KEGG https://www.genome.jp/entry/C18520 enrich_references.chebi_xrefs
kegg.jp https://www.kegg.jp/entry/C18520 enrich_references.pubchem_identifier_url
metabolomicsworkbench.org https://www.metabolomicsworkbench.org/data/StructureData.php?RegNo=56005 enrich_references.pubchem_identifier_url
ppdb ppdb:1132 enrich_references.chebi_xrefs
PubChem https://pubchem.ncbi.nlm.nih.gov/compound/11193251 enrich_references.pubchem_compound
wikidata.org https://www.wikidata.org/wiki/Q17300229 enrich_references.pubchem_identifier_url
Wikipedia https://en.wikipedia.org/wiki/Flubendiamide enrich_references.pubchem_identifier_url

Elementary flows

14
Flow Context Source Unit CFs
b063f487-0d53-492f-920d-a3b3bbadbb27 Environmental → Air → Aircraft cruise height EF 3.1 kg 4
ac0ffa60-5ae1-4a8f-a3c7-0ea0b0d170cf Environmental → Air → Ground level → Urban (>1000 people/square mile) EF 3.1 kg 4
883705db-b432-48da-914f-ae27b737759e Environmental → Air → Indoor EF 3.1 kg 4
54bf630e-06fb-4271-8cd7-ade42c522cb3 Environmental → Air → Long-term EF 3.1 kg 0
19079dbb-d2f5-4e25-887f-4e04427c9d4e Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) EF 3.1 kg 4
e7cdaff7-df95-4996-ae83-a12dd163ce1b Environmental → Air → Unknown EF 3.1 kg 4
29d5697a-c0fb-48c1-9069-8956e6b4924b Environmental → Ground → Agricultural EF 3.1 kg 4
f6bc8856-62b4-4ee5-a9da-b8bcdfb1223b Environmental → Ground → Non-agricultural EF 3.1 kg 4
1ad61fee59c094641e51313f4ba3fc41593ca9ab Environmental → Ground → Silvicultural ecoinvent algorithm addition kg 0
28cc1481-982b-477b-88fd-dda4725d453d Environmental → Ground → Unknown EF 3.1 kg 4
14eacc4d-21bc-47c2-b3d9-ded6ffb0273c Environmental → Water → Long-term EF 3.1 kg 0
809d19a7-477a-46d8-983c-d2463d3f4042 Environmental → Water → Ocean EF 3.1 kg 4
dcd97744-4081-41a6-87a9-fb5c5c84c7ef Environmental → Water → Surface water EF 3.1 kg 4
c765dda6-22df-46a6-b199-4f2d29fbc08f 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-06fe8aeee60a87bb",
  "prefLabel": [
    {
      "@value": "Flubendiamide",
      "@language": "en",
      "@lang": "en",
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          "EF 3.1"
        ],
        "prov:wasDerivedFrom": "Common Chemistry / ChEBI primary name agreement"
      }
    }
  ],
  "altLabel": [
    {
      "@value": "1,2-Benzenedicarboxamide, N2-[1,1-dimethyl-2-(methylsulfonyl)ethyl]-3-iodo-N1-[2-methyl-4-[1,2,2,2-tetrafluoro-1-(trifluoromethyl)ethyl]phenyl]-",
      "@language": "en",
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      }
    },
    {
      "@value": "1-n-[4-(heptafluoropropan-2-yl)-2-methylphenyl]-3-iodo-2-n-(1-methanesulfonyl-2-methylpropan-2-yl)benzene-1,2-dicarboxamide",
      "@language": "en",
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        "prov:wasDerivedFrom": "original name retained as altLabel"
      }
    },
    {
      "@value": "3-Iodo-N2-(2-methyl-1-(methylsulfonyl)propan-2-yl)-N1-(2-methyl-4-(perfluoropropan-2-yl)phenyl)phthalamide",
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    },
    {
      "@value": "Belt",
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    },
    {
      "@value": "Belt 480SC",
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      "@value": "N2-[1,1-Dimethyl-2-(methylsulfonyl)ethyl]-3-iodo-N1-[2-methyl-4-[1,2,2,2-tetrafluoro-1-(trifluoromethyl)ethyl]phenyl]-1,2-benzenedicarboxamide",
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    },
    {
      "@value": "Synapse",
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    {
      "@value": "Takumi (insecticide)",
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