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99902-73-5 | 6-(3,4-DICHLOROPHENOXY)-3-PYRIDINECARBONITRILE
CAS No: 99902-73-5 Catalog No: AG003VUQ MDL No:
Product Description
Catalog Number:
AG003VUQ
Chemical Name:
6-(3,4-DICHLOROPHENOXY)-3-PYRIDINECARBONITRILE
CAS Number:
99902-73-5
Molecular Formula:
C12H6Cl2N2O
Molecular Weight:
265.0948
IUPAC Name:
6-(3,4-dichlorophenoxy)pyridine-3-carbonitrile
InChI:
InChI=1S/C12H6Cl2N2O/c13-10-3-2-9(5-11(10)14)17-12-4-1-8(6-15)7-16-12/h1-5,7H
InChI Key:
AOANSHKOZLKQQA-UHFFFAOYSA-N
SMILES:
N#Cc1ccc(nc1)Oc1ccc(c(c1)Cl)Cl
Properties
Complexity:
304
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
263.986g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
265.093g/mol
Monoisotopic Mass:
263.986g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
45.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.7
Literature
| Title | Journal |
|---|---|
| Antipicornavirus activity of substituted phenoxybenzenes and phenoxypyridines. | Journal of medicinal chemistry 19860301 |
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