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Home Halogens 3-Quinolinecarboxylic acid, 7-chloro-6-fluoro-1,4-dihydro-4-oxo-

3-Quinolinecarboxylic acid, 7-chloro-6-fluoro-1,4-dihydro-4-oxo-

CAS No.:
88569-32-8
Catalog Number:
AG004BNE
Molecular Formula:
C10H5ClFNO3
Molecular Weight:
241.6030
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Product Description
Catalog Number:
AG004BNE
Chemical Name:
3-Quinolinecarboxylic acid, 7-chloro-6-fluoro-1,4-dihydro-4-oxo-
CAS Number:
88569-32-8
Molecular Formula:
C10H5ClFNO3
Molecular Weight:
241.6030
IUPAC Name:
7-chloro-6-fluoro-4-oxo-1H-quinoline-3-carboxylic acid
InChI:
InChI=1S/C10H5ClFNO3/c11-6-2-8-4(1-7(6)12)9(14)5(3-13-8)10(15)16/h1-3H,(H,13,14)(H,15,16)
InChI Key:
FXPLBBILFCVNAA-UHFFFAOYSA-N
SMILES:
OC(=O)c1c[nH]c2c(c1=O)cc(c(c2)Cl)F
Properties
Complexity:
371  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
240.994g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
241.602g/mol
Monoisotopic Mass:
240.994g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
66.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6  
Literature
Title Journal
Synthesis and in vitro antiplasmodial activities of fluoroquinolone analogs. European journal of medicinal chemistry 20120501
Properties