2-bromo-5-(cyclopropylsulfamoyl)benzoic acid


Chemical Name: 2-bromo-5-(cyclopropylsulfamoyl)benzoic acid
CAS Number: 852933-48-3
Product Number: AG00G3UP(AGN-PC-0LK8XX)
Synonyms:
MDL No: MFCD06655613
Molecular Formula: C10H10BrNO4S
Molecular Weight: 320.1597

Identification/Properties


Computed Properties
Molecular Weight:
320.157g/mol
XLogP3:
1.7
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
5
Rotatable Bond Count:
4
Exact Mass:
318.951g/mol
Monoisotopic Mass:
318.951g/mol
Topological Polar Surface Area:
91.8A^2
Heavy Atom Count:
17
Formal Charge:
0
Complexity:
401
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



2-Bromo-5-(N-cyclopropylsulfamoyl)benzoic acid, a versatile compound widely used in chemical synthesis, serves as an important building block in the creation of various organic molecules. Its unique structure containing a bromine atom, a sulfonamide group, and a benzoic acid moiety facilitates its application in the formation of complex structures through a variety of chemical reactions.One of the key applications of 2-Bromo-5-(N-cyclopropylsulfamoyl)benzoic acid lies in its role as a key intermediate in pharmaceutical synthesis. By incorporating this compound into drug molecules, chemists can modify the pharmacokinetic properties, enhance the biological activity, or improve the stability of the final pharmaceutical product. Additionally, this compound can act as a bioisostere or a pharmacophore, contributing to the design and development of novel drug candidates.Moreover, in the field of materials science, 2-Bromo-5-(N-cyclopropylsulfamoyl)benzoic acid is utilized for the synthesis of functional materials with specific properties. Its presence in the molecular structure can impart desirable characteristics such as solubility, conductivity, or stability to the final material product. By incorporating this compound into the polymer backbone or as a functional group, researchers can tailor the material properties to suit various applications in electronics, optics, or coatings.Overall, the versatility of 2-Bromo-5-(N-cyclopropylsulfamoyl)benzoic acid in chemical synthesis enables its widespread use across different industries, showcasing its significance in the development of diverse compounds and materials.