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Home Halogens Ethyl 6-bromo-4-hydroxyquinoline-3-carboxylate

Ethyl 6-bromo-4-hydroxyquinoline-3-carboxylate

CAS No.:
122794-99-4
Catalog Number:
AG000JHT
Molecular Formula:
C12H10BrNO3
Molecular Weight:
296.1167
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$50
- +
5g
98%
In Stock USA
United States
$150
- +
10g
98%
In Stock USA
United States
$288
- +
25g
98%
In Stock USA
United States
$600
- +
Product Description
Catalog Number:
AG000JHT
Chemical Name:
Ethyl 6-bromo-4-hydroxyquinoline-3-carboxylate
CAS Number:
122794-99-4
Molecular Formula:
C12H10BrNO3
Molecular Weight:
296.1167
MDL Number:
MFCD00173362
IUPAC Name:
ethyl 6-bromo-4-oxo-1H-quinoline-3-carboxylate
InChI:
InChI=1S/C12H10BrNO3/c1-2-17-12(16)9-6-14-10-4-3-7(13)5-8(10)11(9)15/h3-6H,2H2,1H3,(H,14,15)
InChI Key:
IVZIOBTVAJBBAS-UHFFFAOYSA-N
SMILES:
CCOC(=O)c1cnc2c(c1O)cc(cc2)Br
Properties
Complexity:
367  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
294.984g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
296.12g/mol
Monoisotopic Mass:
294.984g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
55.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7  
Literature
Title Journal
4-quinolone derivatives: high-affinity ligands at the benzodiazepine site of brain GABA A receptors. synthesis, pharmacology, and pharmacophore modeling. Journal of medicinal chemistry 20060420
Properties