Home Carboxys 8-fluoroquinoline-2,4-dicarboxylic acid

8-fluoroquinoline-2,4-dicarboxylic acid

CAS No.:
250641-22-6
Catalog Number:
AG01DKJP
Molecular Formula:
C11H6FNO4
Molecular Weight:
235.1680
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Product Description
Catalog Number:
AG01DKJP
Chemical Name:
8-fluoroquinoline-2,4-dicarboxylic acid
CAS Number:
250641-22-6
Molecular Formula:
C11H6FNO4
Molecular Weight:
235.1680
MDL Number:
MFCD15527366
IUPAC Name:
8-fluoroquinoline-2,4-dicarboxylic acid
InChI:
InChI=1S/C11H6FNO4/c12-7-3-1-2-5-6(10(14)15)4-8(11(16)17)13-9(5)7/h1-4H,(H,14,15)(H,16,17)
InChI Key:
PADOPEMYRMEZCV-UHFFFAOYSA-N
SMILES:
OC(=O)c1cc(nc2c1cccc2F)C(=O)O
Properties
Complexity:
335  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
235.028g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
235.17g/mol
Monoisotopic Mass:
235.028g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
87.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7  
Properties