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Brc1cnc(nc1)C
Pyrimidine, 5-bromo-2-methyl-
CCCP1(=O)OP(=O)(CCC)OP(=O)(O1)CCC
1,3,5,2,4,6-Trioxatriphosphorinane, 2,4,6-tripropyl-, 2,4,6-trioxide
CC1(C)OB(OC1(C)C)B1OC(C(O1)(C)C)(C)C
2,2'-Bi-1,3,2-dioxaborolane, 4,4,4',4',5,5,5',5'-octamethyl-
O=C(C=Cc1ccccc1)C=Cc1ccccc1.O=C(C=Cc1ccccc1)C=Cc1ccccc1.O=C(C=Cc1ccccc1)C=Cc1ccccc1.[Pd].[Pd]
Tris(dibenzylideneacetone)dipalladium
C1CCC(CC1)P(C1CCCCC1)C1CCCCC1.Cc1cc(C)c(c(c1)C)N1CCN(C1=[Ru](=Cc1ccccc1)(Cl)Cl)c1c(C)cc(cc1C)C
Ruthenium,[1,3-bis(2,4,6-trimethylphenyl)-2-imidazolidinylidene]dichloro(phenylmethylene)(tricyclohexylphosphine)-, (SP-5-41)-

1,3-Benzenedisulfonyl dichloride, 2,4,6-trimethyl-

Cc1c(c(C)cc(c1S(=O)(=O)Cl)C)S(=O)(=O)Cl Request for Quotation
Chemical Name: 1,3-Benzenedisulfonyl dichloride, 2,4,6-trimethyl-
CAS Number: 68985-08-0
Product Number: AG003FVJ(AGN-PC-0KXHDJ)
Synonyms:
MDL No:
Molecular Formula: C9H10Cl2O4S2
Molecular Weight: 317.2093

Identification/Properties

Properties
MP:
125 °C
BP:
428.1°C at 760 mmHg
Storage:
Inert atmosphere;Room Temperature;
Form:
Solid
Computed Properties
Molecular Weight:
317.195g/mol
XLogP3:
3.1
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
2
Exact Mass:
315.94g/mol
Monoisotopic Mass:
315.94g/mol
Topological Polar Surface Area:
85A^2
Heavy Atom Count:
17
Formal Charge:
0
Complexity:
430
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:
Danger
UN#:
3261
Hazard Statements:
H290-H314
Precautionary Statements:
P234-P260-P264-P280-P301+P330+P331+P310-P303+P361+P353+P310+P363-P304+P340+P310-P305+P351+P338+P310-P390-P405-P406-P501
Class:
8
Packing Group:
Ⅲ

NMR Spectrum

Other Analytical Data

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Chemical Structure


2,4,6-Trimethylbenzene-1,3-disulfonyl dichloride, a powerful sulfonation agent, is widely utilized in chemical synthesis as a highly effective sulfonylating reagent. Its unique structure and reactivity make it a valuable tool in various organic transformations and reactions. This compound is commonly employed in the synthesis of biologically active compounds, pharmaceutical intermediates, and functional materials due to its ability to introduce sulfonyl groups into organic molecules with high efficiency. By reacting with nucleophilic sites on aromatic rings, 2,4,6-Trimethylbenzene-1,3-disulfonyl dichloride facilitates the functionalization of organic molecules, leading to the formation of new chemical entities with enhanced properties and functionalities. Furthermore, its sulfonating capabilities enable the selective modification of specific functional groups in complex molecules, allowing chemists to control and manipulate the reactivity and properties of organic compounds with precision. This reagent has found broad applications in the synthesis of agrochemicals, dyes, polymers, and other fine chemicals, illustrating its versatility and importance in modern synthetic chemistry.