6-fluoro-1H-1,3-benzodiazole-4-carboxylic acid


Chemical Name: 6-fluoro-1H-1,3-benzodiazole-4-carboxylic acid
CAS Number: 1193387-31-3
Product Number: AG01EK7M(AGN-PC-0WO70K)
Synonyms:
MDL No: MFCD12912801
Molecular Formula: C8H5FN2O2
Molecular Weight: 180.1359

Identification/Properties


Computed Properties
Molecular Weight:
180.138g/mol
XLogP3:
1.1
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
1
Exact Mass:
180.034g/mol
Monoisotopic Mass:
180.034g/mol
Topological Polar Surface Area:
66A^2
Heavy Atom Count:
13
Formal Charge:
0
Complexity:
224
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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Chemical Structure



6-Fluoro-1H-benzoimidazole-4-carboxylic Acid is a versatile compound widely utilized in chemical synthesis for its unique properties and reactivity. This molecule serves as a key building block in the creation of various pharmaceuticals, agrochemicals, and materials due to its capacity to participate in diverse chemical reactions.In chemical synthesis, 6-Fluoro-1H-benzoimidazole-4-carboxylic Acid acts as a crucial intermediate for the preparation of pharmaceutical compounds. Its fluorinated structure offers increased bioactivity and stability in the final products, making it an ideal component in drug design and development. By incorporating this compound into the synthesis of pharmaceuticals, researchers can enhance the efficacy and specificity of the resulting medications.Furthermore, the presence of the carboxylic acid group in 6-Fluoro-1H-benzoimidazole-4-carboxylic Acid enables facile manipulation of its chemical properties. This functional group allows for the attachment of different substituents through esterification or amidation reactions, thereby expanding the compound's versatility in organic synthesis. Moreover, the fluorine atom provides additional opportunities for fine-tuning the compound's reactivity and interactions with target molecules.Overall, 6-Fluoro-1H-benzoimidazole-4-carboxylic Acid plays a crucial role in the field of chemical synthesis, particularly in the development of pharmaceutical compounds. Its strategic placement and functional groups make it a valuable tool for chemists seeking to create novel and effective chemicals for various applications.