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Home Carboxys 4-Hydroxy-7-trifluoromethyl-3-quinolinecarboxylic acid

4-Hydroxy-7-trifluoromethyl-3-quinolinecarboxylic acid

CAS No.:
574-92-5
Catalog Number:
AG003LIQ
Molecular Formula:
C11H6F3NO3
Molecular Weight:
257.1654
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
In Stock USA
United States
$72
- +
10g
85%
In Stock USA
United States
$253
- +
Product Description
Catalog Number:
AG003LIQ
Chemical Name:
4-Hydroxy-7-trifluoromethyl-3-quinolinecarboxylic acid
CAS Number:
574-92-5
Molecular Formula:
C11H6F3NO3
Molecular Weight:
257.1654
MDL Number:
MFCD00006771
IUPAC Name:
4-oxo-7-(trifluoromethyl)-1H-quinoline-3-carboxylic acid
InChI:
InChI=1S/C11H6F3NO3/c12-11(13,14)5-1-2-6-8(3-5)15-4-7(9(6)16)10(17)18/h1-4H,(H,15,16)(H,17,18)
InChI Key:
BIRIVPOTERXIOW-UHFFFAOYSA-N
SMILES:
OC(=O)c1cnc2c(c1O)ccc(c2)C(F)(F)F
Properties
Complexity:
416  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
257.03g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
7  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
257.168g/mol
Monoisotopic Mass:
257.03g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
66.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7  
Literature
Title Journal
Evaluation of 3-carboxy-4(1H)-quinolones as inhibitors of human protein kinase CK2. Journal of medicinal chemistry 20061102
Microsphere-based protease assays and screening application for lethal factor and factor Xa. Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501
Properties