8-bromoquinoline-2-carboxylic acid


Chemical Name: 8-bromoquinoline-2-carboxylic acid
CAS Number: 914208-15-4
Product Number: AG00GYGU(AGN-PC-05OX0Q)
Synonyms:
MDL No:
Molecular Formula: C10H6BrNO2
Molecular Weight: 252.0641

Identification/Properties


Computed Properties
Molecular Weight:
252.067g/mol
XLogP3:
2.7
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
1
Exact Mass:
250.958g/mol
Monoisotopic Mass:
250.958g/mol
Topological Polar Surface Area:
50.2A^2
Heavy Atom Count:
14
Formal Charge:
0
Complexity:
234
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

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NMR Spectrum


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Chemical Structure



8-Bromoquinoline-2-carboxylic acid is a versatile chemical compound commonly used in chemical synthesis as a key building block. This compound serves as a valuable intermediate in the preparation of various pharmaceuticals, agrochemicals, and other organic compounds. It is particularly valuable in the synthesis of heterocyclic compounds, which are essential in the development of new drugs and biologically active molecules. Additionally, 8-Bromoquinoline-2-carboxylic acid can be utilized in the construction of complex organic frameworks through various reaction pathways, including cross-coupling reactions and heterocycle manipulations. Its unique structure and reactivity make it a valuable tool in the hands of synthetic chemists for the creation of diverse chemical structures with potential applications in the fields of medicine, agriculture, and materials science.