methabenzthiazuron
Identification (Source:EPA,EU)
| ID |
323 |
| Name |
methabenzthiazuron |
| CAS |
18691-97-9 |
| IUPAC |
|
| Inchi |
InChI=1S/C10H11N3OS/c1-11-9(14)13(2)10-12-7-5-3-4-6-8(7)15-10/h3-6H,1-2H3,(H,11,14) |
| CIPAC |
201 |
| EPA Code |
281300 |
| Formula |
C10H11N3OS |
| SMILES |
O=C(NC)N(c1nc2ccccc2s1)C |
| Status |
Not Approved |
Classification
Properties (Source:PubChem)
| Molecular Weight |
221.27 |
| Physical State |
Colourless crystals |
| AlogP |
1.777 |
| H-Bond Donor |
1 |
| H-Bond Acceptor |
2 |
| Surface Area |
218.68 |
| Polar Surface Area |
73.47 |
Structure
Ecotoxicology (Source:PPDB,IPM)
| Species |
Method |
Study Time |
Dose Type |
Value |
| Algae |
Acute |
72 hour |
EC50, growth |
0.033 mg l-1 |
| Algae |
Chronic |
96 hour |
NOEC, growth |
0.018 mg l-1 |
| Aquatic invertebrates |
Acute |
48 hour |
EC50 |
30.6 mg l-1 |
| Birds |
Acute |
|
LD50 |
1000 mg kg-1 |
| Earthworms |
Acute |
14 day |
LD50 |
840 mg kg-1 |
| Fish |
Acute |
96 hour |
LC50 |
15.9 mg l-1 |
| Honeybees |
Acute |
48 hour |
LD50 |
0.8 μg bee-1 |
| Mammals |
Acute oral |
|
LD50 |
> 5000 mg kg-1 |
| Mammals |
Short term dietary |
|
NOEL |
150 ppm diet |
|
Bio-concentration factor |
|
CT50 |
Not available days |
|
Bio-concentration factor |
|
BCF |
75 |
Related targets
| Target Name |
RScore (About this table) |
|
|
transferase
|
32(0,1,1,2) |
Details |
|
CAPE
|
15(0,0,0,15) |
Details |
|
beta catenin
|
11(0,0,0,11) |
Details |
|
bcl 2
|
7(0,0,0,7) |
Details |
|
cyclooxygenase 2
|
7(0,0,0,7) |
Details |
|
CYP1A1
|
6(0,0,0,6) |
Details |
|
P27
|
5(0,0,0,5) |
Details |
|
SK 1
|
4(0,0,0,4) |
Details |
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