3-Bromo-4-hydroxy-2-trifluoromethylquinoline


Chemical Name: 3-Bromo-4-hydroxy-2-trifluoromethylquinoline
CAS Number: 59108-47-3
Product Number: AG003IZU(AGN-PC-0WA87X)
Synonyms:
MDL No:
Molecular Formula: C10H5BrF3NO
Molecular Weight: 292.0520

Identification/Properties


Properties
Storage:
Keep in dry area;2-8℃;
Computed Properties
Molecular Weight:
292.055g/mol
XLogP3:
3.4
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
5
Rotatable Bond Count:
0
Exact Mass:
290.951g/mol
Monoisotopic Mass:
290.951g/mol
Topological Polar Surface Area:
29.1A^2
Heavy Atom Count:
16
Formal Charge:
0
Complexity:
351
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:
N/A
Signal Word:
UN#:
-
Hazard Statements:
-
Precautionary Statements:
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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Chemical Structure



3-Bromo-2-(trifluoromethyl)quinolin-4-ol is a versatile compound widely used in chemical synthesis. This compound serves as a key building block in the creation of various pharmaceuticals, agrochemicals, and materials. Its unique structure and reactivity make it a valuable tool for organic chemists in the development of new molecules with enhanced properties.In chemical synthesis, 3-Bromo-2-(trifluoromethyl)quinolin-4-ol is commonly employed as a precursor in the construction of complex heterocyclic compounds. Its bromine and trifluoromethyl groups enable efficient functionalization and diversification of the quinoline ring system, allowing for the introduction of various substituents at specific positions. This tunability is crucial for fine-tuning the physicochemical properties and biological activities of the final products.Furthermore, the presence of the hydroxyl group in 3-Bromo-2-(trifluoromethyl)quinolin-4-ol facilitates further derivatization through various chemistries, such as O-alkylation, esterification, and metal-catalyzed cross-coupling reactions. This versatility enables the incorporation of additional functionalities or structural motifs into the molecule, expanding its applications in drug discovery, materials science, and other fields.Overall, the strategic use of 3-Bromo-2-(trifluoromethyl)quinolin-4-ol in chemical synthesis enables chemists to access a diverse array of compounds with tailored properties and activities, driving innovation and advancement in the field of organic chemistry.