6-bromo-2H-chromene-3-carboxylic acid


Chemical Name: 6-bromo-2H-chromene-3-carboxylic acid
CAS Number: 380607-15-8
Product Number: AG0076FH(AGN-PC-00UXOW)
Synonyms:
MDL No:
Molecular Formula: C10H7BrO3
Molecular Weight: 255.0648

Identification/Properties


Computed Properties
Molecular Weight:
255.067g/mol
XLogP3:
2.2
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
1
Exact Mass:
253.958g/mol
Monoisotopic Mass:
253.958g/mol
Topological Polar Surface Area:
46.5A^2
Heavy Atom Count:
14
Formal Charge:
0
Complexity:
275
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



6-Bromo-2H-chromene-3-carboxylic acid is a versatile compound that plays a crucial role in chemical synthesis. Its unique structure and properties make it an essential building block in the creation of various pharmaceuticals, agrochemicals, and materials. This compound is commonly used as a key intermediate in the synthesis of biologically active molecules due to its ability to undergo diverse chemical reactions.One of the primary applications of 6-Bromo-2H-chromene-3-carboxylic acid is in the production of heterocyclic compounds, which are vital in drug discovery and development. By functionalizing the bromine atom or the carboxylic acid group, different derivatives of this compound can be obtained, each with distinct properties and potential applications. Additionally, the chromene ring system in this compound serves as a scaffold for further modifications, allowing chemists to tailor the structure for specific purposes.Furthermore, 6-Bromo-2H-chromene-3-carboxylic acid can also be utilized in the synthesis of fluorescent dyes, imaging agents, and molecular probes. Its chromene core exhibits fluorescence properties that are valuable in various analytical and biological applications. By introducing specific substituents or linkers to the molecule, researchers can design fluorescent probes for tracking biological processes or studying molecular interactions.In summary, 6-Bromo-2H-chromene-3-carboxylic acid serves as a crucial building block in chemical synthesis, enabling the creation of diverse compounds with applications in pharmaceuticals, materials, and biotechnology. Its versatility and reactivity make it a valuable tool for synthetic chemists exploring new pathways for molecule design and development.