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99902-71-3

99902-71-3 | 6-(4-ACETYLPHENOXY)-3-PYRIDINECARBONITRILE

CAS No: 99902-71-3 Catalog No: AG003VM7 MDL No:

Product Description

Catalog Number:
AG003VM7
Chemical Name:
6-(4-ACETYLPHENOXY)-3-PYRIDINECARBONITRILE
CAS Number:
99902-71-3
Molecular Formula:
C14H10N2O2
Molecular Weight:
238.2414
IUPAC Name:
6-(4-acetylphenoxy)pyridine-3-carbonitrile
InChI:
InChI=1S/C14H10N2O2/c1-10(17)12-3-5-13(6-4-12)18-14-7-2-11(8-15)9-16-14/h2-7,9H,1H3
InChI Key:
FZBSLZXPXHUBEM-UHFFFAOYSA-N
SMILES:
N#Cc1ccc(nc1)Oc1ccc(cc1)C(=O)C

Properties

Complexity:
339  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
238.074g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
238.246g/mol
Monoisotopic Mass:
238.074g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
63A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1  

Literature

Title Journal
Antipicornavirus activity of substituted phenoxybenzenes and phenoxypyridines. Journal of medicinal chemistry 19860301

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