fenitrothion
Identification (Source:EPA,EU)
| ID |
1548 |
| Name |
fenitrothion |
| CAS |
122-14-5 |
| IUPAC |
|
| Inchi |
InChI=1S/C9H12NO5PS/c1-7-6-8(4-5-9(7)10(11)12)15-16(17,13-2)14-3/h4-6H,1-3H3 |
| CIPAC |
35 |
| EPA Code |
105901 |
| Formula |
C9H12NO5PS |
| SMILES |
S=P(Oc1cc(c(cc1)[N+]([O-])=O)C)(OC)OC |
| Status |
Not Approved |
Classification
Properties (Source:PubChem)
| Molecular Weight |
277.23 |
| Physical State |
Yellow brown liquid |
| AlogP |
2.691 |
| H-Bond Donor |
0 |
| H-Bond Acceptor |
6 |
| Surface Area |
265.59 |
| Polar Surface Area |
115.41 |
Structure
Ecotoxicology (Source:PPDB,IPM)
| Species |
Method |
Study Time |
Dose Type |
Value |
| Algae |
Acute |
72 hour |
EC50, growth |
1.3 mg l-1 |
| Algae |
Chronic |
96 hour |
NOEC, growth |
0.1 mg l-1 |
| Aquatic invertebrates |
Chronic |
21 day |
NOEC |
0.000087 mg l-1 |
| Aquatic invertebrates |
Acute |
48 hour |
EC50 |
0.0086 mg l-1 |
| Birds |
Short term dietary |
|
LC50/LD50 |
23 mg/kg bw/day |
| Birds |
Acute |
|
LD50 |
2.3 mg kg-1 |
| Earthworms |
Acute |
14 day |
LD50 |
231 mg kg-1 |
| Earthworms |
Chronic |
14 day |
NOEC, reproduction |
25 mg kg-1 |
| Fish |
Chronic |
21 day |
NOEC |
0.088 mg l-1 |
| Fish |
Acute |
96 hour |
LC50 |
1.3 mg l-1 |
| Honeybees |
Acute |
48 hour |
LD50 |
0.16 μg bee-1 |
| Mammals |
Acute oral |
|
LD50 |
330 mg kg-1 |
| Mammals |
Short term dietary |
|
NOEL |
> 10 ppm diet |
| Sediment dwelling organisms |
Chronic |
28 day |
NOEC, sediment |
0.0017 mg kg-1 |
|
Bio-concentration factor |
|
CT50 |
0.19 days |
|
Bio-concentration factor |
|
BCF |
29 |
Related targets
| Target Name |
RScore (About this table) |
|
|
Acetylcholinesterase
|
1610(10,26,56,180) |
Details |
|
cholinesterase
|
899(6,13,34,104) |
Details |
|
androgen receptor
|
192(1,4,6,12) |
Details |
|
cytochrome P450 (protein family or complex)
|
119(1,2,2,9) |
Details |
|
hemoglobins (protein family or complex)
|
119(1,1,6,14) |
Details |
|
C18
|
96(1,1,2,11) |
Details |
|
lactate dehydrogenase (protein family or complex)
|
88(1,1,1,8) |
Details |
|
DTNB
|
88(1,1,2,3) |
Details |
|
Dragon
|
87(1,1,2,2) |
Details |
|
SRBC
|
87(1,1,2,2) |
Details |
|
alanine aminotransferase
|
85(1,1,1,5) |
Details |
|
alkaline phosphatases
|
81(1,1,1,1) |
Details |
|
interleukin 1
|
81(1,1,1,1) |
Details |
|
ribonucleotide reductase (protein family or complex)
|
81(1,1,1,1) |
Details |
|
neurotoxic esterase
|
52(0,1,4,7) |
Details |
|
ATPase
|
45(0,1,3,5) |
Details |
|
MN1
|
39(0,1,2,4) |
Details |
|
brains
|
38(0,1,2,3) |
Details |
|
microsomal monooxygenases
|
37(0,1,2,2) |
Details |
|
multidrug resistance associated protein 1
|
34(0,1,1,4) |
Details |
|
CYP2D6
|
33(0,1,1,3) |
Details |
|
CYP3A4
|
33(0,1,1,3) |
Details |
|
glutathione transferase
|
32(0,1,1,2) |
Details |
|
CYP2C9
|
32(0,1,1,2) |
Details |
|
CYP1A1
|
32(0,1,1,2) |
Details |
|
CYP2B6
|
31(0,1,1,1) |
Details |
|
glutathione S transferase
|
24(0,0,2,14) |
Details |
|
glutamyl transpeptidase
|
22(0,0,3,7) |
Details |
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