CAS 2654-52-6

Benzothiazolium, 2,3-dimethyl-, 4-methylbenzenesulfonate (1:1)

Description:

Benzothiazolium, 2,3-dimethyl-, 4-methylbenzenesulfonate (1:1) is a chemical compound characterized by its unique structure, which includes a benzothiazolium cation and a sulfonate anion. This compound typically exhibits properties associated with both the benzothiazole and sulfonate functional groups, such as solubility in polar solvents and potential applications in various chemical reactions. The presence of multiple methyl groups in its structure can influence its reactivity and stability, often enhancing its lipophilicity. Benzothiazolium salts are known for their role as intermediates in organic synthesis and can serve as dyes or pigments due to their chromophoric properties. Additionally, they may exhibit biological activity, making them of interest in pharmaceutical research. The compound's CAS number, 2654-52-6, allows for easy identification and retrieval of information regarding its safety, handling, and regulatory status. Overall, this compound is significant in both industrial and research contexts, particularly in the fields of organic chemistry and materials science.

Formula: C₁₆H₁₇NO₃S₂

InChI: InChI=1/C9H10NS.C7H8O3S/c1-7-10(2)8-5-3-4-6-9(8)11-7;1-6-2-4-7(5-3-6)11(8,9)10/h3-6H,1-2H3;2-5H,1H3,(H,8,9,10)/q+1;/p-1

InChI key: InChIKey=GYHJFWZSCIYJKD-UHFFFAOYSA-M

SMILES: C[N+]=1C=2C(SC1C)=CC=CC2.S(=O)(=O)([O-])C1=CC=C(C)C=C1

Synonyms:

• 2,3-Dimethyl-1,3-Benzothiazol-3-Ium 4-Methylbenzenesulfonate
• 2,3-Dimethylbenzothiazolium p-toluenesulfonate
• 2,3-Dimethylbenzothiazolium toluenesulfonate
• 2,3-Dimethylbenzothiazolium tosylate
• 2,3-Dimethylthiobenzothiazolinium tosylate
• Benzothiazolium, 2,3-dimethyl-, 4-methylbenzenesulfonate (1:1)
• Benzothiazolium, 2,3-dimethyl-, p-toluenesulfonate
• Benzothiazolium, 2,3-dimethyl-, salt with 4-methylbenzenesulfonic acid (1:1)
• 2,3-Dimethylbenzothiazolium p-toluenesulphonate

2,3-Dimethylbenzo[d]thiazol-3-ium 4-methylbenzenesulfonate

CAS: 2654-52-6

Formula: C₁₆H₁₇NO₃S₂

Molecular weight: 335.4411

Ref: IN-DA002TMM

2,3-Dimethyl-1,3-benzothiazol-3-ium,4-methylbenzene-1-sulfonate

CAS: 2654-52-6

2,3-Dimethyl-1,3-benzothiazol-3-ium,4-methylbenzene-1-sulfonate is a non-selective fluorescent dye that has been shown to be an effective diagnostic tool for the detection of single strands of DNA. This compound is used in the lab to identify single nucleotide polymorphisms. 2,3-Dimethyl-1,3-benzothiazol-3-ium,4-methylbenzene-1sulfonate can be synthesized from ferrocene and its optical properties can be modified by substituting the sulfur atom with other heterocycles such as thiophene or benzothiazole. The fluorescence of this compound can be further enhanced by protonation or by attaching a fluorescent probe such as rhodamine B.

Formula: C₁₆H₁₇NO₃S₂

Purity: Min. 95%

Color and Shape: Powder

Molecular weight: 335.44 g/mol

Ref: 3D-FD151807