prochloraz
Identification (Source:EPA,EU)
| ID |
403 |
| Name |
prochloraz |
| CAS |
67747-09-5 |
| IUPAC |
|
| Inchi |
InChI=1S/C15H16Cl3N3O2/c1-2-4-20(15(22)21-5-3-19-10-21)6-7-23-14-12(17)8-11(16)9-13(14)18/h3,5,8-10H,2,4,6-7H2,1H3 |
| CIPAC |
407 |
| EPA Code |
128851 |
| Formula |
C15H16Cl3N3O2 |
| SMILES |
CCCN(CCOC1=C(C=C(C=C1Cl)Cl)Cl)C(=O)N2C=CN=C2 |
| Status |
Approved |
Classification
Properties (Source:PubChem)
| Molecular Weight |
376.7 |
| Physical State |
Colourless to white crystals |
| AlogP |
4.406 |
| H-Bond Donor |
0 |
| H-Bond Acceptor |
3 |
| Surface Area |
351.02 |
| Polar Surface Area |
47.36 |
Structure
Ecotoxicology (Source:PPDB,IPM)
| Species |
Method |
Study Time |
Dose Type |
Value |
| Algae |
Chronic |
96 hour |
NOEC, growth |
0.01 mg l-1 |
| Algae |
Acute |
72 hour |
EC50, growth |
> 0.0055 mg l-1 |
| Aquatic crustaceans |
Acute |
96 hour |
LC50 |
0.77 mg l-1 |
| Aquatic invertebrates |
Acute |
48 hour |
EC50 |
4.3 mg l-1 |
| Aquatic plants |
Acute |
7 day |
EC50, biomass |
0.171 mg l-1 |
| Birds |
Short term dietary |
|
LC50/LD50 |
> 1580 mg/kg bw/day |
| Birds |
Acute |
|
LD50 |
662 mg kg-1 |
| Earthworms |
Chronic |
14 day |
NOEC, reproduction |
4.2 mg kg-1 |
| Earthworms |
Acute |
14 day |
LD50 |
> 500 mg kg-1 |
| Fish |
Chronic |
21 day |
NOEC |
0.049 mg l-1 |
| Fish |
Acute |
96 hour |
LC50 |
1.5 mg l-1 |
| Honeybees |
Acute |
48 hour |
LD50 |
> 101 μg bee-1 |
| Mammals |
Acute oral |
|
LD50 |
1023 mg kg-1 |
| Sediment dwelling organisms |
Acute |
96 hour |
LC50 |
= mg l-1 |
| Sediment dwelling organisms |
Chronic |
28 day |
NOEC, sediment |
0.8 mg kg-1 |
|
Bio-concentration factor |
|
BCF |
371 |
|
Bio-concentration factor |
|
CT50 |
3.4 days |
Related targets
| Target Name |
RScore (About this table) |
|
|
androgen receptor
|
360(4,5,5,10) |
Details |
|
cytochrome P450 (protein family or complex)
|
330(3,5,7,20) |
Details |
|
CYP17
|
172(2,2,2,12) |
Details |
|
butyrylcholinesterase
|
164(2,2,2,4) |
Details |
|
AhR
|
166(1,3,4,21) |
Details |
|
P glycoprotein
|
116(1,2,2,6) |
Details |
|
glutathione S transferase
|
83(1,1,1,3) |
Details |
|
follicle stimulating hormone receptor
|
81(1,1,1,1) |
Details |
|
CYP19
|
83(0,2,3,18) |
Details |
|
estrogen receptor
|
71(0,1,6,16) |
Details |
|
CYP51
|
44(0,1,2,9) |
Details |
|
demethylase
|
37(0,1,1,7) |
Details |
|
angiotensin II
|
32(0,1,1,2) |
Details |
|
cyp11a
|
32(0,1,1,2) |
Details |
|
beta glucuronidase
|
31(0,1,1,1) |
Details |
|
CYP21A2
|
31(0,1,1,1) |
Details |
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