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Home Carboxys 4-Hydroxy-6-(trifluoromethyl)-3-quinolinecarboxylic acid

4-Hydroxy-6-(trifluoromethyl)-3-quinolinecarboxylic acid

CAS No.:
49713-47-5
Catalog Number:
AG003LII
Molecular Formula:
C11H6F3NO3
Molecular Weight:
257.1654
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$25
- +
5g
98%
In Stock USA
United States
$88
- +
25g
98%
In Stock USA
United States
$375
- +
Product Description
Catalog Number:
AG003LII
Chemical Name:
4-Hydroxy-6-(trifluoromethyl)-3-quinolinecarboxylic acid
CAS Number:
49713-47-5
Molecular Formula:
C11H6F3NO3
Molecular Weight:
257.1654
MDL Number:
MFCD00236691
IUPAC Name:
4-oxo-6-(trifluoromethyl)-1H-quinoline-3-carboxylic acid
InChI:
InChI=1S/C11H6F3NO3/c12-11(13,14)5-1-2-8-6(3-5)9(16)7(4-15-8)10(17)18/h1-4H,(H,15,16)(H,17,18)
InChI Key:
VUPSPASQZKLXMI-UHFFFAOYSA-N
SMILES:
OC(=O)c1cnc2c(c1O)cc(cc2)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  
Properties