Brightway Flows 1.0
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Halofenozide

fo-1e36f42145baad5c

Identity

Type
Neutral molecule
CAS
112226-61-6
EC
431-600-4
Origin
EF 3.1 hybrid_name_cas_v1
Changes
58 across every transformer

Structure

Structure diagram for Halofenozide

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

8

Properties

PropertyValue
Elemental charge chemrof:elemental_charge 0
InChI2D key string chemrof:inchi2d_key_string CNKHSLKYRMDDNQ-UHFFFAOYSA-N
InChI2D string chemrof:inchi2d_string InChI=1S/C18H19ClN2O2/c1-18(2,3)21(17(23)14-7-5-4-6-8-14)20-16(22)13-9-11-15(19)12-10-13/h4-12H,1-3H3,(H,20,22)
IUPAC name chemrof:IUPAC_name 4-chlorobenzoic acid 2-benzoyl-2-(1,1-dimethylethyl)hydrazide
Molecular formula chemrof:molecular_formula C18H19ClN2O2
Molecular mass chemrof:molecular_mass 330.815
Monoisotopic mass chemrof:monoisotopic_mass 330.113506, 330.11351
SMILES string chemrof:smiles_string CC(C)(C)N(NC(=O)c1ccc(Cl)cc1)C(=O)c1ccccc1

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
beilstein beilstein:8421868 enrich_references.chebi_xrefs
CAS Common Chemistry https://commonchemistry.cas.org/detail?cas_rn=112226-61-6 enrich_references.chebi_xrefs
ChEBI https://www.ebi.ac.uk/chebi/searchId.do?chebiId=CHEBI:38451 enrich_references.chebi_id_link
chem.echa.europa.eu https://chem.echa.europa.eu/100.102.990 enrich_references.pubchem_identifier_url
chem.echa.europa.eu https://chem.echa.europa.eu/100.119.258 enrich_references.pubchem_identifier_url
comptox.epa.gov https://comptox.epa.gov/dashboard/DTXSID4032619 enrich_references.pubchem_identifier_url
ebi.ac.uk https://www.ebi.ac.uk/chembl/explore/compound/CHEMBL226969 enrich_references.pubchem_identifier_url
gsrs.ncats.nih.gov https://gsrs.ncats.nih.gov/ginas/app/beta/substances/C81K20PELV enrich_references.pubchem_identifier_url
HMDB https://hmdb.ca/metabolites/HMDB0253040 enrich_references.pubchem_identifier_url
jglobal.jst.go.jp http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J816.015E enrich_references.pubchem_identifier_url
KEGG https://www.genome.jp/entry/C18791 enrich_references.chebi_xrefs
kegg.jp https://www.kegg.jp/entry/C18791 enrich_references.pubchem_identifier_url
metabolomicsworkbench.org https://www.metabolomicsworkbench.org/data/StructureData.php?RegNo=55871 enrich_references.pubchem_identifier_url
ppdb ppdb:376 enrich_references.chebi_xrefs
PubChem https://pubchem.ncbi.nlm.nih.gov/compound/114994 enrich_references.pubchem_compound
Wikidata https://www.wikidata.org/wiki/Q27117858 enrich_references.pubchem_identifier_url

Elementary flows

15
Flow Context Source Unit CFs
64b1ce4f-6556-11dd-ad8b-0800200c9a66 Environmental → Air → Aircraft cruise height EF 3.1 kg 2
4d9a8790-3ddd-11dd-9bfe-0050c2490048 Environmental → Air → Ground level → Urban (>1000 people/square mile) EF 3.1 kg 2
67feccee-90b0-41b7-86d9-fc700885dc12 Environmental → Air → Indoor EF 3.1 kg 2
4d9a8790-3ddd-11dd-9bfd-0050c2490048 Environmental → Air → Long-term EF 3.1 kg 0
4d9a8790-3ddd-11dd-9bff-0050c2490048 Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) EF 3.1 kg 2
4d9a8790-3ddd-11dd-9bfc-0050c2490048 Environmental → Air → Unknown EF 3.1 kg 2
08a91e70-3ddc-11dd-a17a-0050c2490048 Environmental → Ground → Agricultural EF 3.1 kg 2
4d9a8790-3ddd-11dd-9c03-0050c2490048 Environmental → Ground → Non-agricultural EF 3.1 kg 2
228a397f5f04b75e9857eccda4aed93602dda1d2 Environmental → Ground → Silvicultural ecoinvent algorithm addition kg 0
08a91e70-3ddc-11dd-a17b-0050c2490048 Environmental → Ground → Unknown EF 3.1 kg 2
4d9a8790-3ddd-11dd-9c01-0050c2490048 Environmental → Water → Long-term EF 3.1 kg 0
4d9a8790-3ddd-11dd-9c04-0050c2490048 Environmental → Water → Ocean EF 3.1 kg 2
4d9a8790-3ddd-11dd-9c00-0050c2490048 Environmental → Water → Surface water EF 3.1 kg 2
a8a9f77c593c5494da9b52a02f69372e06807c6c Environmental → Water → Unconfined aquifer stepwise algorithm addition kg 0
4d9a8790-3ddd-11dd-9c02-0050c2490048 Environmental → Water → Unknown EF 3.1 kg 2

History

Everything that changed this substance (58 changes)

Open the changes page

Full record

Flow object JSON 
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}

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