toluene-4-sulfonic acid 3-Methanesulfonyl-propyl ester


Chemical Name: toluene-4-sulfonic acid 3-Methanesulfonyl-propyl ester
CAS Number: 263400-88-0
Product Number: AG002STT(AGN-PC-0WAFEJ)
Synonyms:
MDL No:
Molecular Formula: C11H16O5S2
Molecular Weight: 292.3717

Identification/Properties


Properties
Storage:
Keep in dry area;Room Temperature;
Form:
Solid
Computed Properties
Molecular Weight:
292.364g/mol
XLogP3:
1.2
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
5
Rotatable Bond Count:
6
Exact Mass:
292.044g/mol
Monoisotopic Mass:
292.044g/mol
Topological Polar Surface Area:
94.3A^2
Heavy Atom Count:
18
Formal Charge:
0
Complexity:
433
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



3-(Methylsulfonyl)propyl 4-methylbenzenesulfonate is a versatile compound commonly used in chemical synthesis as a key building block for the production of various specialty chemicals. This compound is particularly valuable in organic synthesis due to its unique structural properties and reactivity.In chemical synthesis, 3-(Methylsulfonyl)propyl 4-methylbenzenesulfonate can serve as a valuable source of functional groups for the modification of organic molecules. Its sulfonate group can participate in nucleophilic substitution reactions, allowing for the introduction of the 3-(methylsulfonyl)propyl moiety into target compounds. This moiety can then be further functionalized or utilized as a linker in the synthesis of more complex molecules.Furthermore, 3-(Methylsulfonyl)propyl 4-methylbenzenesulfonate can also act as a protecting group for sensitive functional groups in organic synthesis. By selectively masking certain reactive sites within a molecule with this compound, chemists can control the sequence of chemical reactions and prevent unwanted side reactions. Subsequent deprotection steps can then reveal the original functional groups, enabling the synthesis of intricate molecular structures.Overall, the versatile nature of 3-(Methylsulfonyl)propyl 4-methylbenzenesulfonate makes it an indispensable tool in the arsenal of synthetic chemists for the construction of complex organic molecules and the development of novel materials with tailored properties.