tembotrione
Identification (Source:EPA,EU)
| ID |
873 |
| Name |
tembotrione |
| CAS |
335104-84-2 |
| IUPAC |
2-{2-chloro-4-mesyl-3-[(2,2,2-trifluoroethoxy)methyl]benzoyl}cyclohexane-1,3-dione |
| Inchi |
InChI=1S/C17H16ClF3O6S/c1-28(25,26)13-6-5-9(15(18)10(13)7-27-8-17(19,20)21)16(24)14-11(22)3-2-4-12(14)23/h5-6,14H,2-4,7-8H2,1H3 |
| CIPAC |
790 |
| EPA Code |
012801 |
| Formula |
C17H16ClF3O6S |
| SMILES |
CS(c1c(COCC(F)(F)F)c(Cl)c(C(C2C(=O)CCCC2=O)=O)cc1)(=O)=O |
| Status |
PENDING |
Classification
Properties (Source:PubChem)
| Molecular Weight |
440.82 |
| Physical State |
Beige powder |
| AlogP |
2.695 |
| H-Bond Donor |
0 |
| H-Bond Acceptor |
6 |
| Surface Area |
377.89 |
| Polar Surface Area |
102.96 |
Structure
Ecotoxicology (Source:PPDB,IPM)
| Species |
Method |
Study Time |
Dose Type |
Value |
| Algae |
Acute |
72 hour |
EC50, growth |
0.38 mg l-1 |
| Aquatic crustaceans |
Acute |
96 hour |
LC50 |
0.1 mg l-1 |
| Aquatic invertebrates |
Chronic |
21 day |
NOEC |
5.0 mg l-1 |
| Aquatic plants |
Acute |
7 day |
EC50, biomass |
0.006 mg l-1 |
| Birds |
Acute |
|
LD50 |
> 292 mg kg-1 |
| Birds |
Short term dietary |
|
LC50/LD50 |
> 1788 mg/kg bw/day |
| Earthworms |
Acute |
14 day |
LD50 |
> 1000 mg kg-1 |
| Earthworms |
Chronic |
14 day |
NOEC, reproduction |
1.25 mg kg-1 |
| Fish |
Acute |
96 hour |
LC50 |
> 100 mg l-1 |
| Fish |
Chronic |
21 day |
NOEC |
100 mg l-1 |
| Honeybees |
Acute |
48 hour |
LD50 |
> 92.8 μg bee-1 |
| Mammals |
Acute oral |
|
LD50 |
> 2500 mg kg-1 |
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