tri-allate
Identification (Source:EPA,EU)
| ID |
1101 |
| Name |
tri-allate |
| CAS |
2303-17-5 |
| IUPAC |
|
| Inchi |
InChI=1S/C10H16Cl3NOS/c1-6(2)14(7(3)4)10(15)16-5-8(11)9(12)13/h6-7H,5H2,1-4H3 |
| CIPAC |
97 |
| EPA Code |
078802 |
| Formula |
C10H16Cl3NOS |
| SMILES |
CC(C)N(C(C)C)C(=O)SCC(=C(Cl)Cl)Cl |
| Status |
Approved |
Classification
Properties (Source:PubChem)
| Molecular Weight |
304.7 |
| Physical State |
White crystalline solid |
| AlogP |
3.96 |
| H-Bond Donor |
0 |
| H-Bond Acceptor |
2 |
| Surface Area |
298.09 |
| Polar Surface Area |
45.61 |
Structure
Ecotoxicology (Source:PPDB,IPM)
| Species |
Method |
Study Time |
Dose Type |
Value |
| Algae |
Acute |
72 hour |
EC50, growth |
0.0022 mg l-1 |
| Algae |
Chronic |
96 hour |
NOEC, growth |
0.032 mg l-1 |
| Aquatic invertebrates |
Chronic |
21 day |
NOEC |
0.013 mg l-1 |
| Aquatic invertebrates |
Acute |
48 hour |
EC50 |
0.091 mg l-1 |
| Aquatic plants |
Acute |
7 day |
EC50, biomass |
2.3 mg l-1 |
| Birds |
Short term dietary |
|
LC50/LD50 |
> 1208 mg/kg bw/day |
| Birds |
Acute |
|
LD50 |
1560 mg kg-1 |
| Earthworms |
Acute |
14 day |
LD50 |
> 274.5 mg kg-1 |
| Earthworms |
Chronic |
14 day |
NOEC, reproduction |
13.62 mg kg-1 |
| Fish |
Acute |
96 hour |
LC50 |
0.95 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 |
1100 mg kg-1 |
| Mammals |
Short term dietary |
|
NOEL |
3.9 mg kg-1 |
| Mammals |
Short term dietary |
|
NOEL |
20 ppm diet |
| Sediment dwelling organisms |
Chronic |
28 day |
NOEC, sediment |
0.583 mg kg-1 |
| Sediment dwelling organisms |
Acute |
96 hour |
LC50 |
1.0 mg l-1 |
|
Bio-concentration factor |
|
CT50 |
Not available days |
|
Bio-concentration factor |
|
BCF |
1400 |
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