Benzenesulfonamide, 2-methyl-


Chemical Name: Benzenesulfonamide, 2-methyl-
CAS Number: 88-19-7
Product Number: AG0033E7(AGN-PC-0C1CF6)
Synonyms:
MDL No:
Molecular Formula: C7H9NO2S
Molecular Weight: 171.2169

Identification/Properties


Properties
MP:
155 °C
BP:
221 °C
Storage:
Keep in dry area;Room Temperature;
Form:
Solid
Refractive Index:
1.6100 (estimate)
Computed Properties
Molecular Weight:
171.214g/mol
XLogP3:
0.8
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
1
Exact Mass:
171.035g/mol
Monoisotopic Mass:
171.035g/mol
Topological Polar Surface Area:
68.5A^2
Heavy Atom Count:
11
Formal Charge:
0
Complexity:
217
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:
H319
Precautionary Statements:
P305+P351+P338
Class:
N/A
Packing Group:
N/A

NMR Spectrum


Other Analytical Data


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Chemical Structure



2-Methylbenzene-1-sulfonamide, also known as toluenesulfonamide, is a versatile chemical compound widely used in chemical synthesis. It serves as a valuable building block in the production of various pharmaceuticals, agrochemicals, and fine chemicals. 2-Methylbenzene-1-sulfonamide is often employed as a protecting group for amines during organic reactions, helping to control regioselectivity and enhance reaction yields. Additionally, this compound can act as a reagent in organic transformations, such as the formation of amides and sulfonamides through coupling reactions. Its unique properties make it a crucial intermediate in the synthesis of complex organic molecules and play a vital role in the development of new chemical entities in the pharmaceutical industry.