Consensus flow list

Identity

Type
NeutralMolecule
CAS
86479-06-3
EC
Origin
ecoinvent-3.12 hybrid_name_cas_v1
Changes
0 across every transformer

Structure

Structure diagram for Hexaflumuron

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

2

Properties

PropertyValue
Elemental charge chemrof:elemental_charge 0
InChI2D key string chemrof:inchi2d_key_string RGNPBRKPHBKNKX-UHFFFAOYSA-N
InChI2D string chemrof:inchi2d_string InChI=1S/C16H8Cl2F6N2O3/c17-7-4-6(5-8(18)12(7)29-16(23,24)14(21)22)25-15(28)26-13(27)11-9(19)2-1-3-10(11)20/h1-5,14H,(H2,25,26,27,28)
IUPAC name chemrof:IUPAC_name 1-(3,5-dichloro-4-(1,1,2,2-tetrafluoroethoxy)phenyl)-3-(2,6-difluorobenzoyl)urea
Molecular formula chemrof:molecular_formula C16H8Cl2F6N2O3
Molecular mass chemrof:molecular_mass 461.145
Monoisotopic mass chemrof:monoisotopic_mass 459.981617, 459.98162
SMILES string chemrof:smiles_string O=C(NC(=O)c1c(F)cccc1F)Nc1cc(Cl)c(OC(F)(F)C(F)F)c(Cl)c1

Known URLs

5

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=86479-06-3 enrich_references.chebi_xrefs
ChEBI https://www.ebi.ac.uk/chebi/searchId.do?chebiId=CHEBI:39383 enrich_references.chebi_id_link
KEGG https://www.genome.jp/entry/C18861 enrich_references.chebi_xrefs
pesticides pesticides:hexaflumuron enrich_references.chebi_xrefs
ppdb ppdb:383 enrich_references.chebi_xrefs

Elementary flows

7
Flow Context Source Unit CFs
b0581f4c4bd5da5294b538588e66a2a4c60955dc Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) ecoinvent algorithm addition kg 0
0c814569fb6d3d3d0b0cb3690d4a1b2a9e4cac69 Environmental → Air → Unknown ecoinvent algorithm addition kg 0
a8690f04ec3ad36e1753be2751cb773af92d1618 Environmental → Ground → Agricultural ecoinvent algorithm addition kg 0
bb9dab9a25f222e976a464d6ae3eb93b01da4f5f Environmental → Ground → Silvicultural ecoinvent algorithm addition kg 0
ac71133aa59a458126c81e40e495ecb6db53c23c Environmental → Ground → Unknown ecoinvent algorithm addition kg 0
a5cda090780ef8c3d1764c4198014d031352c4c4 Environmental → Water → Surface water ecoinvent algorithm addition kg 0
0aa3a5a096547aa2eb77e331dc2042529ee41149 Environmental → Water → Unknown ecoinvent algorithm addition kg 0

History

Everything that changed this substance (0 changes)

Open the changes page

Full record

Flow object JSON
{
  "flow_object_id": "fo-baf66efeaeea5cc8",
  "prefLabel": [
    {
      "@value": "Hexaflumuron",
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  ],
  "altLabel": [
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      }
    },
    {
      "@value": "N-({[3,5-dichloro-4-(1,1,2,2-tetrafluoroethoxy)phenyl]amino}carbonyl)-2,6-difluorobenzamide",
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      "@value": "An N-acylurea that is urea in which a hydrogen attached to one of the nitrogens is replaced by a 2,6-difluorobenzoyl group, while a hycrogen attached to the other nitorgen is replaced by a 3,5-dichloro-4-(1,1,2,2-tetrafluoroethoxy)phenyl group.",
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}

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