ethion

Identification (Source:EPA,EU)

ID 219
Name ethion
CAS 563-12-2
IUPAC
Inchi InChI=1S/C9H22O4P2S4/c1-5-10-14(16,11-6-2)18-9-19-15(17,12-7-3)13-8-4/h5-9H2,1-4H3
CIPAC 102
EPA Code 058401
Formula C9H22O4P2S4
SMILES S=P(SCSP(=S)(OCC)OCC)(OCC)OCC
Status Not Approved

Classification

Mode of Action Non-systemic with a predominate contact action. Acetylcholine esterase inhibitor.
Pesticide Type Insecticide, Acaricide, Metabolite
Chemical Group Organophosphate
Classification organothiophosphate insecticides
aliphatic organothiophosphate insecticides
organothiophosphate acaricides

Properties (Source:PubChem)

Molecular Weight 384.48
Physical State Amber liquid
AlogP 3.781
H-Bond Donor 0
H-Bond Acceptor 8
Surface Area 367.14
Polar Surface Area 171.31

Structure



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3D similarity method

2D similarity method

Compound Database



Bioactivity Database

KEGG (5,928)

PDB (7,072)


Similarity Threshold

Ecotoxicology (Source:PPDB,IPM)

Species Method Study Time Dose Type Value
Aquatic invertebrates Acute 48 hour EC50 0.000056 mg l-1
Birds Acute LD50 128 mg kg-1
Fish Acute 96 hour LC50 0.5 mg l-1
Honeybees Acute 48 hour LD50 20.6 μg bee-1
Mammals Acute oral LD50 208 mg kg-1
Mammals Short term dietary NOEL 0.3 mg kg-1
Mammals Short term dietary NOEL 6 ppm diet
Bio-concentration factor BCF 586
Bio-concentration factor CT50 Not available days

Related targets

Target Name RScore (About this table)
cholinesterase 18(0,0,2,8) Details
Acetylcholinesterase 12(0,0,1,7) Details
glutathione S transferase 7(0,0,0,7) Details
CD127 7(0,0,1,2) Details
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