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1022091-54-8,MFCD17011786
Catalog No.:AA0006UE
1022091-54-8 | 2-(7-Fluoroquinolin-6-yl)acetic acid
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Purity
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1g
95%
in stock  
$788.00   $552.00
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Technical Information
Catalog Number:
AA0006UE
Chemical Name:
2-(7-Fluoroquinolin-6-yl)acetic acid
CAS Number:
1022091-54-8
Molecular Formula:
C11H8FNO2
Molecular Weight:
205.1851
MDL Number:
MFCD17011786
IUPAC Name:
2-(7-fluoroquinolin-6-yl)acetic acid
InChI:
InChI=1S/C11H8FNO2/c12-9-6-10-7(2-1-3-13-10)4-8(9)5-11(14)15/h1-4,6H,5H2,(H,14,15)
InChI Key:
QLIYCOZDTFRSOW-UHFFFAOYSA-N
SMILES:
OC(=O)Cc1cc2cccnc2cc1F
Properties
Computed Properties
 
Complexity:
247  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
205.054g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
205.188g/mol
Monoisotopic Mass:
205.054g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
50.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8  

Synonyms
 
2-(7-fluoroquinolin-6-yl)acetic acid 
1022091-54-8 
ACN-037420 
AK162720 
AX8294763 
TC-063357 
CS-0060668 
(7-Fluoro-quinolin-6-yl)-acetic acid 
SCHEMBL3150247 
CTK8C6599 
QLIYCOZDTFRSOW-UHFFFAOYSA-N 
6-Quinolineacetic acid, 7-fluoro- 
MFCD17011786 
ZINC67172952 
AKOS015856179 
Literature
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