dichlorophen
Identification (Source:EPA,EU)
ID |
317 |
Name |
dichlorophen |
CAS |
97-23-4 |
IUPAC |
|
Inchi |
InChI=1S/C13H10Cl2O2/c14-10-1-3-12(16)8(6-10)5-9-7-11(15)2-4-13(9)17/h1-4,6-7,16-17H,5H2 |
CIPAC |
325 |
EPA Code |
055001 |
Formula |
C13H10Cl2O2 |
SMILES |
Clc1cc(c(O)cc1)Cc2cc(Cl)ccc2O |
Status |
Not Approved |
Classification
Properties (Source:PubChem)
Molecular Weight |
269.1 |
Physical State |
Colourless crystals |
AlogP |
4.649 |
H-Bond Donor |
2 |
H-Bond Acceptor |
2 |
Surface Area |
242.4 |
Polar Surface Area |
40.46 |
Structure
Ecotoxicology (Source:PPDB,IPM)
Species |
Method |
Study Time |
Dose Type |
Value |
Algae |
Acute |
72 hour |
EC50, growth |
10 mg l-1 |
Aquatic invertebrates |
Acute |
48 hour |
EC50 |
6.2 mg l-1 |
Fish |
Acute |
96 hour |
LC50 |
0.54 mg l-1 |
Mammals |
Acute oral |
|
LD50 |
2690 mg kg-1 |
Mammals |
Short term dietary |
|
NOEL |
2000 ppm diet |
|
Bio-concentration factor |
|
BCF |
45.4 |
|
Bio-concentration factor |
|
CT50 |
Not available days |
Related targets
Target Name |
RScore (About this table) |
|
NK2
|
35(0,1,1,5) |
Details |
mark 4
|
31(0,1,1,1) |
Details |
NK 1 receptor
|
31(0,1,1,1) |
Details |
cis 2
|
31(0,1,1,1) |
Details |
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