Benzenesulfonyl chloride, 4-(1,1-dimethylethyl)-2,6-dimethyl-


Chemical Name: Benzenesulfonyl chloride, 4-(1,1-dimethylethyl)-2,6-dimethyl-
CAS Number: 70823-04-0
Product Number: AG005FU4(AGN-PC-0L1AUT)
Synonyms:
MDL No: MFCD02018257
Molecular Formula: C12H17ClO2S
Molecular Weight: 260.7802

Identification/Properties


Computed Properties
Molecular Weight:
260.776g/mol
XLogP3:
4.3
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
2
Rotatable Bond Count:
2
Exact Mass:
260.064g/mol
Monoisotopic Mass:
260.064g/mol
Topological Polar Surface Area:
42.5A^2
Heavy Atom Count:
16
Formal Charge:
0
Complexity:
325
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



4-(tert-Butyl)-2,6-dimethylbenzene-1-sulfonyl chloride, also known as '$name$', is a versatile reagent utilized in various chemical synthesis processes. This compound acts as a sulfonylating agent, meaning it is commonly employed to introduce sulfonyl functional groups onto organic molecules.In organic synthesis, $name$ is often utilized to modify and functionalize other organic compounds. It effectively adds sulfonyl groups to nucleophiles, such as alcohols, amines, and phenols, through sulfonylation reactions. This transformation is valuable in the creation of new compounds with specific properties or functionalities, making it a crucial tool in the realm of medicinal chemistry, material science, and agrochemical development.Moreover, 4-(tert-Butyl)-2,6-dimethylbenzene-1-sulfonyl chloride is frequently employed in the synthesis of pharmaceutical intermediates and biologically active molecules. Its ability to introduce sulfonyl moieties in a controlled manner enables chemists to design and construct complex molecules with precision, facilitating the discovery and development of novel drugs and therapeutic agents.In summary, the application of $name$ in chemical synthesis lies in its role as a sulfonylating reagent, enabling the selective modification of organic molecules and the creation of valuable intermediates for various industries and research endeavors.