3-Quinolinecarboxylicacid, 8-bromo-4-hydroxy-


Chemical Name: 3-Quinolinecarboxylicacid, 8-bromo-4-hydroxy-
CAS Number: 35973-17-2
Product Number: AG003NHQ(AGN-PC-0O9AYT)
Synonyms:
MDL No:
Molecular Formula: C10H6BrNO3
Molecular Weight: 268.0635

Identification/Properties


Properties
BP:
409 °C at 760 mmHg
Storage:
Room Temperature;
Computed Properties
Molecular Weight:
268.066g/mol
XLogP3:
2.5
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
1
Exact Mass:
266.953g/mol
Monoisotopic Mass:
266.953g/mol
Topological Polar Surface Area:
66.4A^2
Heavy Atom Count:
15
Formal Charge:
0
Complexity:
340
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

Safety Information


GHS Pictogram:
Signal Word:
Warning
UN#:
-
Hazard Statements:
H319
Precautionary Statements:
P305+P351+P338
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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Chemical Structure



8-Bromo-4-hydroxyquinoline-3-carboxylic acid is a versatile compound commonly used in chemical synthesis for its valuable functional groups and reactivity. This molecule serves as a crucial building block in the creation of a wide range of pharmaceuticals, agrochemicals, and materials. Its bromo and hydroxy functionalities make it particularly valuable in the development of novel compounds through organic transformations and derivatization reactions. This acid derivative allows for the introduction of specific substituents at precise positions in the quinoline ring system, enabling the synthesis of target molecules with enhanced biological or physical properties. In addition, the carboxylic acid group provides a convenient site for further modification, such as esterification or amidation, to tailor the compound's solubility, stability, or interactions with other molecules. Due to its synthetic utility and potential applications in drug discovery and materials science, 8-Bromo-4-hydroxyquinoline-3-carboxylic acid plays a vital role in the advancement of chemistry and related fields.