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Home Carboxys 6-Methoxy-4-oxo-1,4-dihydroquinoline-3-carboxylic acid

6-Methoxy-4-oxo-1,4-dihydroquinoline-3-carboxylic acid

CAS No.:
34785-07-4
Catalog Number:
AG00BZ6V
Molecular Formula:
C11H9NO4
Molecular Weight:
219.1935
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
In Stock USA
United States
$226
- +
5g
95%
In Stock USA
United States
$671
- +
Product Description
Catalog Number:
AG00BZ6V
Chemical Name:
6-Methoxy-4-oxo-1,4-dihydroquinoline-3-carboxylic acid
CAS Number:
34785-07-4
Molecular Formula:
C11H9NO4
Molecular Weight:
219.1935
MDL Number:
MFCD00844091
IUPAC Name:
6-methoxy-4-oxo-1H-quinoline-3-carboxylic acid
InChI:
InChI=1S/C11H9NO4/c1-16-6-2-3-9-7(4-6)10(13)8(5-12-9)11(14)15/h2-5H,1H3,(H,12,13)(H,14,15)
InChI Key:
YUXLPEGMXYHPCZ-UHFFFAOYSA-N
SMILES:
COc1ccc2c(c1)c(=O)c(c[nH]2)C(=O)O
NSC Number:
80675
Properties
Complexity:
350  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
219.053g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
219.196g/mol
Monoisotopic Mass:
219.053g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
75.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8  
Literature
Title Journal
Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis. Bioorganic & medicinal chemistry letters 20101101
Evaluation of 3-carboxy-4(1H)-quinolones as inhibitors of human protein kinase CK2. Journal of medicinal chemistry 20061102
Properties