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1416439-57-0

1416439-57-0 | 3-Quinolinecarboxylic acid, 5-fluoro-

CAS No: 1416439-57-0 Catalog No: AG001GS9 MDL No:

Product Description

Catalog Number:
AG001GS9
Chemical Name:
3-Quinolinecarboxylic acid, 5-fluoro-
CAS Number:
1416439-57-0
Molecular Formula:
C10H6FNO2
Molecular Weight:
191.1585
IUPAC Name:
5-fluoroquinoline-3-carboxylic acid
InChI:
InChI=1S/C10H6FNO2/c11-8-2-1-3-9-7(8)4-6(5-12-9)10(13)14/h1-5H,(H,13,14)
InChI Key:
XQTAMMFETWWSQG-UHFFFAOYSA-N
SMILES:
OC(=O)c1cnc2c(c1)c(F)ccc2

Properties

Complexity:
234  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
191.038g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
191.161g/mol
Monoisotopic Mass:
191.038g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
50.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8  

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