Benzenesulfonamide, N-(2-hydroxyethyl)-4-methyl-


Chemical Name: Benzenesulfonamide, N-(2-hydroxyethyl)-4-methyl-
CAS Number: 14316-14-4
Product Number: AG007Z2A(AGN-PC-0KA2W4)
Synonyms:
MDL No:
Molecular Formula: C9H13NO3S
Molecular Weight: 215.2694

Identification/Properties


Computed Properties
Molecular Weight:
215.267g/mol
XLogP3:
0.6
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
4
Exact Mass:
215.062g/mol
Monoisotopic Mass:
215.062g/mol
Topological Polar Surface Area:
74.8A^2
Heavy Atom Count:
14
Formal Charge:
0
Complexity:
250
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#:
N/A
Hazard Statements:
H302-H315-H319-H335
Precautionary Statements:
P261-P305+P351+P338
Class:
N/A
Packing Group:
N/A

NMR Spectrum


Other Analytical Data


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Chemical Structure



The N-(2-Hydroxyethyl)-4-methylbenzenesulfonamide is a versatile compound widely utilized in chemical synthesis as a crucial building block for the development of various pharmaceuticals, agrochemicals, and advanced materials. This compound serves as a valuable intermediate in the synthesis of a wide range of bioactive molecules due to its unique structural properties and functional groups. Its hydroxyethyl and sulfonamide moieties play a significant role in forming key pharmacophores or reactive sites that are essential for molecular interactions and transformations in chemical reactions. In addition, the presence of the methyl group on the benzene ring enhances the compound's stability and influences the overall reactivity and selectivity in organic transformations. Overall, the N-(2-Hydroxyethyl)-4-methylbenzenesulfonamide compound offers immense potential in facilitating the synthesis of complex chemical entities with diverse applications in the fields of drug discovery, material science, and agrochemical research.