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8-Nitroquinoline

CAS No.:
607-35-2
Catalog Number:
AG003705
Molecular Formula:
C9H6N2O2
Molecular Weight:
174.1561
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
5g
98%
In Stock USA
United States
$19
- +
25g
98%
In Stock USA
United States
$53
- +
100g
98%
In Stock USA
United States
$138
- +
500g
98%
In Stock USA
United States
$563
- +
Product Description
Catalog Number:
AG003705
Chemical Name:
8-Nitroquinoline
CAS Number:
607-35-2
Molecular Formula:
C9H6N2O2
Molecular Weight:
174.1561
MDL Number:
MFCD00006806
IUPAC Name:
8-nitroquinoline
InChI:
InChI=1S/C9H6N2O2/c12-11(13)8-5-1-3-7-4-2-6-10-9(7)8/h1-6H
InChI Key:
OQHHSGRZCKGLCY-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1cccc2c1nccc2
EC Number:
210-135-9
UNII:
YWO6S88V4V
NSC Number:
346
Properties
Complexity:
202  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
174.043g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
174.159g/mol
Monoisotopic Mass:
174.043g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
58.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4  
Literature
Title Journal
Discovery of a new antileishmanial hit in 8-nitroquinoline series. European journal of medicinal chemistry 20120801
8-Nitro-quinoline. Acta crystallographica. Section E, Structure reports online 20110401
Fragmentation mechanisms in electron ionization mass spectrometry of 5-nitro- and 8-nitroquinoline: a comparative study. Rapid communications in mass spectrometry : RCM 20080101
Ring-substituted quinolines as potential anti-tuberculosis agents. Bioorganic & medicinal chemistry 20040515
[Formations and reactions of aromatic furazan compounds]. Yakugaku zasshi : Journal of the Pharmaceutical Society of Japan 20010601
Properties