chloroxynil

Identification (Source:EPA,EU)

ID 971
Name chloroxynil
CAS 1891-95-8
IUPAC 3,5-dichloro-4-hydroxybenzonitrile
Inchi InChI=1S/C7H3Cl2NO/c8-5-1-4(3-10)2-6(9)7(5)11/h1-2,11H
CIPAC
EPA Code
Formula C7H3Cl2NO
SMILES Clc1c([H])c(C#N)c([H])c(c1O[H])Cl
Status Not Available

Classification

Mode of Action
Pesticide Type
Chemical Group
Classification nitrile herbicides

Properties (Source:PubChem)

Molecular Weight 188.01081
Physical State
AlogP 2.795
H-Bond Donor 1
H-Bond Acceptor 2
Surface Area 172.95
Polar Surface Area 44.02

Structure



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3D similarity method

2D similarity method

Compound Database



Bioactivity Database

KEGG (5,928)

PDB (7,072)


Similarity Threshold

Related targets

Target Name RScore (About this table)
Nitrilase 1 2(0,0,0,2) Details
nitrilase (protein family or complex) 2(0,0,0,2) Details
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