Consensus flow list

Fenhexamid

fo-76a78bdfe3263802

Identity

Type
NeutralMolecule
CAS
126833-17-8
EC
422-530-5
Origin
EF 3.1 hybrid_name_cas_v1
Changes
59 across every transformer

Structure

Structure diagram for Fenhexamid

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

8

Properties

PropertyValue
Elemental charge chemrof:elemental_charge 0
InChI2D key string chemrof:inchi2d_key_string VDLGAVXLJYLFDH-UHFFFAOYSA-N
InChI2D string chemrof:inchi2d_string InChI=1S/C14H17Cl2NO2/c1-14(7-3-2-4-8-14)13(19)17-9-5-6-10(18)12(16)11(9)15/h5-6,18H,2-4,7-8H2,1H3,(H,17,19)
IUPAC name chemrof:IUPAC_name 2',3'-dichloro-4'-hydroxy-1-methylcyclohexanecarboxanilide
Molecular formula chemrof:molecular_formula C14H17Cl2NO2
Molecular mass chemrof:molecular_mass 302.201
Monoisotopic mass chemrof:monoisotopic_mass 301.06363, 301.063634
SMILES string chemrof:smiles_string CC1(C(=O)Nc2ccc(O)c(Cl)c2Cl)CCCCC1

Known URLs

25

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
agr agr:IND500627165 enrich_references.chebi_xrefs
CAS Common Chemistry https://commonchemistry.cas.org/detail?cas_rn=126833-17-8 enrich_references.chebi_xrefs
ChEBI https://www.ebi.ac.uk/chebi/searchId.do?chebiId=CHEBI:81853 enrich_references.chebi_id_link
chem.echa.europa.eu https://chem.echa.europa.eu/100.102.110 enrich_references.pubchem_identifier_url
chem.echa.europa.eu https://chem.echa.europa.eu/100.112.947 enrich_references.pubchem_identifier_url
comptox.epa.gov https://comptox.epa.gov/dashboard/DTXSID3032549 enrich_references.pubchem_identifier_url
ebi.ac.uk https://www.ebi.ac.uk/chembl/explore/compound/CHEMBL1688541 enrich_references.pubchem_identifier_url
gsrs.ncats.nih.gov https://gsrs.ncats.nih.gov/ginas/app/beta/substances/Q68C3C9P1U enrich_references.pubchem_identifier_url
HMDB https://hmdb.ca/metabolites/HMDB0252201 enrich_references.pubchem_identifier_url
jglobal.jst.go.jp http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J1.063.660D enrich_references.pubchem_identifier_url
KEGG https://www.genome.jp/entry/C18593 enrich_references.chebi_xrefs
kegg.jp https://www.kegg.jp/entry/C18593 enrich_references.pubchem_identifier_url
patent patent:EP339418 enrich_references.chebi_xrefs
patent patent:US5059623 enrich_references.chebi_xrefs
pesticides pesticides:fenhexamid enrich_references.chebi_xrefs
ppdb ppdb:298 enrich_references.chebi_xrefs
PubChem https://pubchem.ncbi.nlm.nih.gov/compound/213031 enrich_references.pubchem_compound
PubChem https://pubchem.ncbi.nlm.nih.gov/substance/?source=niaid&sourceid=578670 enrich_references.pubchem_identifier_url
PubMed https://pubmed.ncbi.nlm.nih.gov/17390774 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/19285148 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/22045588 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/23052036 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/23139232 enrich_references.chebi_xrefs
reaxys reaxys:8996658 enrich_references.chebi_xrefs
wikidata.org https://www.wikidata.org/wiki/Q63395375 enrich_references.pubchem_identifier_url

Elementary flows

14
Flow Context Source Unit CFs
9362b1b9-85f4-461e-9e11-a81d9bfa9c91 Environmental → Air → Aircraft cruise height EF 3.1 kg 4
31dd155f-6aa9-4e9c-8314-36fe62c004d0 Environmental → Air → Ground level → Urban (>1000 people/square mile) EF 3.1 kg 4
2893eb7d-8a43-41e6-9e3e-4fce8d2fc748 Environmental → Air → Indoor EF 3.1 kg 4
7777b9f6-69b0-4eca-a92f-af1d44b4a521 Environmental → Air → Long-term EF 3.1 kg 0
15987895-a40d-4f79-a785-610a54851e1e Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) EF 3.1 kg 4
a805ef64-8215-4c68-8b9a-d1b13359642a Environmental → Air → Unknown EF 3.1 kg 4
2bbc8a79-08c6-4252-8b42-d0ea63d39018 Environmental → Ground → Agricultural EF 3.1 kg 4
bca75737-ad5a-4f0b-a244-8a98d86132e9 Environmental → Ground → Non-agricultural EF 3.1 kg 4
9b26a86744f2943685933676d52c480cf187cc99 Environmental → Ground → Silvicultural ecoinvent algorithm addition kg 0
59102e0b-214a-4a3a-82b1-9157234822ae Environmental → Ground → Unknown EF 3.1 kg 4
61cf72bf-37fd-4443-ab5e-0408898eb845 Environmental → Water → Long-term EF 3.1 kg 0
36d6160b-980d-40a2-b8c5-a66868ba391f Environmental → Water → Ocean EF 3.1 kg 4
3cb32e65-263a-4a40-a2c2-a92c559a5070 Environmental → Water → Surface water EF 3.1 kg 4
d5655d21-edf2-4c0e-a918-241c49384fbf Environmental → Water → Unknown EF 3.1 kg 4

History

Everything that changed this substance (59 changes)

Open the changes page

Full record

Flow object JSON 
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