fluoroglycofen

Identification (Source:EPA,EU)

ID 941
Name fluoroglycofen
CAS 77501-60-1
IUPAC
Inchi InChI=1S/C16H9ClF3NO7/c17-11-5-8(16(18,19)20)1-4-13(11)28-9-2-3-12(21(25)26)10(6-9)15(24)27-7-14(22)23/h1-6H,7H2,(H,22,23)
CIPAC 523
EPA Code
Formula C16H9ClF3NO7
SMILES Clc2cc(ccc2Oc1cc(C(=O)OCC(=O)O)c([N+]([O-])=O)cc1)C(F)(F)
Status Not Approved

Classification

Mode of Action Induces the accumulation of tetrapyroles which attack plant cells
Pesticide Type Herbicide
Chemical Group Diphenyl ether
Classification nitrophenyl ether herbicides

Properties (Source:PubChem)

Molecular Weight 419.69
Physical State Dark amber solid
AlogP 4.228
H-Bond Donor 1
H-Bond Acceptor 7
Surface Area 359.29
Polar Surface Area 118.65

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
Algae Acute 72 hour EC50, growth 0.00018 mg l-1
Aquatic invertebrates Acute 48 hour EC50 30 mg l-1
Birds Acute LD50 1418 mg kg-1
Earthworms Acute 14 day LD50 6 mg kg-1
Fish Acute 96 hour LC50 23 mg l-1
Fish Chronic 21 day NOEC 0.038 mg l-1
Honeybees Acute 48 hour LD50 100 μg bee-1
Mammals Acute oral LD50 1480 mg kg-1
Bio-concentration factor CT50 Not available days
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