quinmerac

Identification (Source:EPA,EU)

ID 859
Name quinmerac
CAS 90717-03-6
IUPAC 7-chloro-3-methylquinoline-8-carboxylic acid
Inchi InChI=1S/C11H8ClNO2/c1-6-4-7-2-3-8(12)9(11(14)15)10(7)13-5-6/h2-5H,1H3,(H,14,15)
CIPAC 563
EPA Code 129181
Formula C11H8ClNO2
SMILES O=C(O)c1c(Cl)ccc2cc(cnc12)C
Status Approved

Classification

Mode of Action Absorbed by roots, synthetic auxin
Pesticide Type Herbicide
Chemical Group Quinoline
Classification quinolinecarboxylic acid herbicides

Properties (Source:PubChem)

Molecular Weight 221.6
Physical State Colourless crystalline solid
AlogP 2.796
H-Bond Donor 1
H-Bond Acceptor 3
Surface Area 207.62
Polar Surface Area 50.19

Structure



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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 48.5 mg l-1
Algae Chronic 96 hour NOEC, growth 20 mg l-1
Aquatic invertebrates Chronic 21 day NOEC > 100 mg l-1
Aquatic invertebrates Acute 48 hour EC50 > 100 mg l-1
Aquatic plants Acute 7 day EC50, biomass 96 mg l-1
Birds Short term dietary LC50/LD50 > 933 mg/kg bw/day
Birds Acute LD50 > 2000 mg kg-1
Earthworms Acute 14 day LD50 > 1000 mg kg-1
Fish Chronic 21 day NOEC 3.16 mg l-1
Fish Acute 96 hour LC50 86.8 mg l-1
Honeybees Acute 48 hour LD50 > 100 μg bee-1
Mammals Acute oral LD50 > 5000 mg kg-1
Mammals Short term dietary NOEL > 468.8 mg kg-1
Mammals Short term dietary NOEL > 6000 ppm diet
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