1-bromo-2-(ethanesulfonyl)benzene


Chemical Name: 1-bromo-2-(ethanesulfonyl)benzene
CAS Number: 1299474-17-1
Product Number: AG000TT0(AGN-PC-0WAJQI)
Synonyms:
MDL No:
Molecular Formula: C8H9BrO2S
Molecular Weight: 249.1249

Identification/Properties


Computed Properties
Molecular Weight:
249.122g/mol
XLogP3:
2.2
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
2
Rotatable Bond Count:
2
Exact Mass:
247.951g/mol
Monoisotopic Mass:
247.951g/mol
Topological Polar Surface Area:
42.5A^2
Heavy Atom Count:
12
Formal Charge:
0
Complexity:
230
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:
Signal Word:
Warning
UN#:
-
Hazard Statements:
H315-H319
Precautionary Statements:
P264-P280-P302+P352-P305+P351+P338-P332+P313-P337+P313-P362
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


Request for Quotation


Customer Feedback


Chemical Structure



1-Bromo-2-(ethanesulfonyl)benzene, also known as benzyl bromide, is a versatile chemical reagent commonly used in organic synthesis. This compound is valued for its ability to undergo various reactions, making it a valuable intermediate in the production of pharmaceuticals, agrochemicals, and other fine chemicals.In chemical synthesis, 1-Bromo-2-(ethanesulfonyl)benzene serves as a key building block for the synthesis of various compounds. One of its primary applications is in the preparation of sulfonamides, which are important structural motifs found in many biologically active molecules. By reacting with amines, 1-Bromo-2-(ethanesulfonyl)benzene can form sulfonamide derivatives through a substitution reaction, expanding the chemical diversity of the final products.Furthermore, 1-Bromo-2-(ethanesulfonyl)benzene can participate in cross-coupling reactions, such as the Suzuki-Miyaura coupling, to introduce the benzyl group onto other molecules. This allows for the creation of more complex organic compounds with specific functionalities tailored for different applications.Overall, the versatility of 1-Bromo-2-(ethanesulfonyl)benzene in chemical synthesis makes it a valuable tool for organic chemists looking to design and create novel compounds with diverse applications in various industries.