sulcotrione

Identification (Source:EPA,EU)

ID 871
Name sulcotrione
CAS 99105-77-8
IUPAC 2-(2-chloro-4-mesylbenzoyl)cyclohexane-1,3-dione
Inchi InChI=1S/C14H13ClO5S/c1-21(19,20)8-5-6-9(10(15)7-8)14(18)13-11(16)3-2-4-12(13)17/h5-7,13H,2-4H2,1H3
CIPAC 723
EPA Code
Formula C14H13ClO5S
SMILES O=C(c1ccc(cc1Cl)S(=O)(=O)C)C2C(=O)CCCC2=O
Status Approved

Classification

Mode of Action Absorbed mainly by the leaves but also some root uptake. 4-HPPD inhibitor.
Pesticide Type Herbicide
Chemical Group Triketone
Classification benzoylcyclohexanedione herbicides

Properties (Source:PubChem)

Molecular Weight 328.77
Physical State White solid
AlogP 1.883
H-Bond Donor 0
H-Bond Acceptor 5
Surface Area 291.0
Polar Surface Area 93.72

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 1.2 mg l-1
Aquatic invertebrates Acute 48 hour EC50 > 848 mg l-1
Aquatic invertebrates Chronic 21 day NOEC > 75 mg l-1
Aquatic plants Acute 7 day EC50, biomass 0.051 mg l-1
Birds Short term dietary LC50/LD50 > 1259 mg/kg bw/day
Birds Acute LD50 > 1350 mg kg-1
Earthworms Acute 14 day LD50 > 1000 mg kg-1
Fish Acute 96 hour LC50 227 mg l-1
Fish Chronic 21 day NOEC 3.2 mg l-1
Honeybees Acute 48 hour LD50 50 μg bee-1
Mammals Acute oral LD50 > 5000 mg kg-1
Mammals Short term dietary NOEL > 0.5 mg kg-1
Mammals Short term dietary NOEL > 100 ppm diet

Related targets

Target Name RScore (About this table)
4 hydroxyphenylpyruvate dioxygenase 202(2,3,3,12) Details
ha 1 31(0,1,1,1) Details
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