acetochlor

Identification (Source:EPA,EU)

ID 812
Name acetochlor
CAS 34256-82-1
IUPAC
Inchi InChI=1S/C14H20ClNO2/c1-4-12-8-6-7-11(3)14(12)16(10-18-5-2)13(17)9-15/h6-8H,4-5,9-10H2,1-3H3
CIPAC 496
EPA Code 121601
Formula C14H20ClNO2
SMILES ClCC(=O)N(c1c(cccc1CC)C)COCC
Status Not Approved

Classification

Mode of Action Selective, absorbed mainly by shoots and roots of germinating weeds. Lipid synthesis inhibitor.
Pesticide Type Herbicide
Chemical Group Chloroacetamide
Classification chloroacetanilide herbicides
anilide herbicides

Properties (Source:PubChem)

Molecular Weight 269.77
Physical State Pale yellow liquid
AlogP 3.317
H-Bond Donor 0
H-Bond Acceptor 2
Surface Area 283.74
Polar Surface Area 29.54

Structure



ChemMapper Search Option (Docunmentation of ChemMapper)

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
Algae Acute 72 hour EC50, growth 0.00027 mg l-1
Algae Chronic 96 hour NOEC, growth 0.00059 mg l-1
Aquatic crustaceans Acute 96 hour LC50 1.9 mg l-1
Aquatic invertebrates Chronic 21 day NOEC 0.022 mg l-1
Aquatic invertebrates Acute 48 hour EC50 8.6 mg l-1
Aquatic plants Acute 7 day EC50, biomass 0.0027 mg l-1
Birds Acute LD50 928 mg kg-1
Birds Short term dietary LC50/LD50 1057 mg/kg bw/day
Earthworms Acute 14 day LD50 105.5 mg kg-1
Fish Acute 96 hour LC50 0.36 mg l-1
Fish Chronic 21 day NOEC 0.13 mg l-1
Honeybees Acute 48 hour LD50 > 100 μg bee-1
Mammals Acute oral LD50 1929 mg kg-1
Mammals Short term dietary NOEL > 10 mg kg-1
Sediment dwelling organisms Chronic 28 day NOEC, sediment 1.6 mg kg-1
Bio-concentration factor CT50 Not available days
Bio-concentration factor BCF 20

Related targets

Target Name RScore (About this table)
estrogen receptor 195(2,3,3,5) Details
cytochrome P450 (protein family or complex) 165(2,2,2,5) Details
MDR1 114(1,2,2,4) Details
MRP1 113(1,2,2,3) Details
CLPP 87(1,1,2,2) Details
PTMA 81(0,2,5,6) Details
TRbeta 37(0,1,2,2) Details
CYP3A4 33(0,1,1,3) Details
thyroperoxidase 33(0,1,1,3) Details
MRP2 32(0,1,1,2) Details
BCRP 31(0,1,1,1) Details
CYP2B6 31(0,1,1,1) Details
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