phosalone
Identification (Source:EPA,EU)
| ID |
231 |
| Name |
phosalone |
| CAS |
2310-17-0 |
| IUPAC |
|
| Inchi |
InChI=1S/C12H15ClNO4PS2/c1-3-16-19(20,17-4-2)21-8-14-10-6-5-9(13)7-11(10)18-12(14)15/h5-7H,3-4,8H2,1-2H3 |
| CIPAC |
109 |
| EPA Code |
097701 |
| Formula |
C12H15ClNO4PS2 |
| SMILES |
Clc2ccc1c(OC(=O)N1CSP(=S)(OCC)OCC)c2 |
| Status |
Not Approved |
Classification
Properties (Source:PubChem)
| Molecular Weight |
367.8 |
| Physical State |
Colourless crystals |
| AlogP |
4.001 |
| H-Bond Donor |
0 |
| H-Bond Acceptor |
6 |
| Surface Area |
328.08 |
| Polar Surface Area |
115.2 |
Structure
Ecotoxicology (Source:PPDB,IPM)
| Species |
Method |
Study Time |
Dose Type |
Value |
| Algae |
Chronic |
96 hour |
NOEC, growth |
0.1 mg l-1 |
| Algae |
Acute |
72 hour |
EC50, growth |
1.1 mg l-1 |
| Aquatic invertebrates |
Chronic |
21 day |
NOEC |
0.00014 mg l-1 |
| Aquatic invertebrates |
Acute |
48 hour |
EC50 |
0.00074 mg l-1 |
| Birds |
Acute |
|
LD50 |
503 mg kg-1 |
| Birds |
Short term dietary |
|
LC50/LD50 |
1659 mg/kg feed |
| Earthworms |
Acute |
14 day |
LD50 |
22.5 mg kg-1 |
| Fish |
Acute |
96 hour |
LC50 |
0.63 mg l-1 |
| Fish |
Chronic |
21 day |
NOEC |
0.056 mg l-1 |
| Honeybees |
Acute |
48 hour |
LD50 |
4.4 μg bee-1 |
| Mammals |
Acute oral |
|
LD50 |
120 mg kg-1 |
| Mammals |
Short term dietary |
|
NOEL |
3.5 mg kg-1 |
| Sediment dwelling organisms |
Chronic |
28 day |
NOEC, sediment |
0.019 mg kg-1 |
|
Bio-concentration factor |
|
BCF |
180 |
|
Bio-concentration factor |
|
CT50 |
0.71 days |
Related targets
| Target Name |
RScore (About this table) |
|
|
Acetylcholinesterase
|
220(2,3,6,15) |
Details |
|
anticholinesterase
|
102(1,1,3,12) |
Details |
|
ATPases
|
82(1,1,1,2) |
Details |
|
Koc
|
38(0,1,2,3) |
Details |
|
alkaline phosphatase
|
37(0,1,2,2) |
Details |
|
p50
|
31(0,1,1,1) |
Details |
|
intestinal alkaline phosphatase
|
31(0,1,1,1) |
Details |
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