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151515-56-9 | Phenol, 3,5-dichloro-2,6-bis(2,4-dichlorophenoxy)-
CAS No: 151515-56-9 Catalog No: AG001NEK MDL No:
Product Description
Catalog Number:
AG001NEK
Chemical Name:
Phenol, 3,5-dichloro-2,6-bis(2,4-dichlorophenoxy)-
CAS Number:
151515-56-9
Molecular Formula:
C18H8Cl6O3
Molecular Weight:
484.9723
IUPAC Name:
3,5-dichloro-2,6-bis(2,4-dichlorophenoxy)phenol
InChI:
InChI=1S/C18H8Cl6O3/c19-8-1-3-14(10(21)5-8)26-17-12(23)7-13(24)18(16(17)25)27-15-4-2-9(20)6-11(15)22/h1-7,25H
InChI Key:
GRQNRKQXLLLWGN-UHFFFAOYSA-N
SMILES:
Clc1ccc(c(c1)Cl)Oc1c(Cl)cc(c(c1O)Oc1ccc(cc1Cl)Cl)Cl
Properties
Complexity:
446
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
483.858g/mol
Formal Charge:
0
Heavy Atom Count:
27
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
484.959g/mol
Monoisotopic Mass:
481.86g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
38.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
8.4
Literature
| Title | Journal |
|---|---|
| Biological activities of cyanobacteria: evaluation of extracts and pure compounds. | Planta medica 19950801 |
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