Cas no 536-57-2 (4-Methylbenzenesulfinic acid)

4-Methylbenzenesulfinic acid (CAS 536-57-2) is an organosulfur compound with the molecular formula C?H?O?S. It serves as a versatile intermediate in organic synthesis, particularly in the preparation of sulfones and sulfoxides through oxidation reactions. The compound exhibits good solubility in polar solvents, facilitating its use in homogeneous reaction conditions. Its benzylic sulfinate structure makes it a useful reagent for nucleophilic sulfinylation reactions. Additionally, 4-methylbenzenesulfinic acid is employed in asymmetric synthesis and catalysis due to its ability to act as a chiral auxiliary or ligand precursor. The product is typically supplied as a white to off-white crystalline solid with high purity, ensuring consistent performance in synthetic applications.
4-Methylbenzenesulfinic acid structure
4-Methylbenzenesulfinic acid structure
Product Name:4-Methylbenzenesulfinic acid
CAS No:536-57-2
MF:C7H8O2S
MW:156.202220916748
MDL:MFCD00058979
CID:82456
PubChem ID:10818
Update Time:2025-05-23

4-Methylbenzenesulfinic acid Chemical and Physical Properties

Names and Identifiers

    • 4-Methylbenzenesulfinic acid
    • 4-methyl-Benzenesulfinicacid
    • toluene-4-sulphinicacid
    • toluenesulfinicacid
    • P-TOLUENESULFINIC ACID
    • 4-TOLUENESULFINIC ACID
    • P-TOLUENESULFINIC ACID,MP 88-90DEG
    • p-toluenesulfmic acid
    • CS-W022214
    • J-515775
    • p-methyl benzenesulfinic acid
    • InChI=1/C7H8O2S/c1-6-2-4-7(5-3-6)10(8)9/h2-5H,1H3,(H,8,9
    • SCHEMBL50106
    • A870665
    • Para-toluenesulfinic acid
    • Toluene-4-sulphinic acid
    • 536-57-2
    • 4-methylbenzene-1-sulfinic acid
    • Q2823311
    • Benzenesulfinic acid, 4-methyl-
    • p-Toluene Sulfinic Acid
    • 109100-36-9
    • 4-Toluenesulphinic acid
    • para-toluene sulfinic acid
    • P-TOLUENESULFINIC ACID [MI]
    • EINECS 208-638-3
    • toluene-4-sulfinic acid
    • NS00080172
    • DS-14167
    • UNII-H3F863QFL6
    • H3F863QFL6
    • 4-methyl-benzenesulfinic acid
    • F21290
    • 4-Methylbenzenesulfinic acid #
    • AKOS003273157
    • DTXSID90862432
    • 4-(ISOPROPYLTHIO)-1,3-DIMETHYL-1H-PYRAZOLO[3,4-B]PYRIDINE-5-CARBOXYLICACID
    • p-toluenesulphinic acid
    • MFCD00058979
    • SY113268
    • MDL: MFCD00058979
    • Inchi: 1S/C7H8O2S/c1-6-2-4-7(5-3-6)10(8)9/h2-5H,1H3,(H,8,9)
    • InChI Key: FXJVNINSOKCNJP-UHFFFAOYSA-N
    • SMILES: S(C1C=CC(C)=CC=1)(=O)O

Computed Properties

  • Exact Mass: 156.02500
  • Monoisotopic Mass: 156.02450067g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 10
  • Rotatable Bond Count: 1
  • Complexity: 132
  • Covalently-Bonded Unit Count: 2
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • Surface Charge: 0
  • Topological Polar Surface Area: 40.1
  • XLogP3: 1.5

Experimental Properties

  • Color/Form: Not determined
  • Density: 1.2474 (rough estimate)
  • Melting Point: 85°
  • Boiling Point: 250.45°C (rough estimate)
  • Refractive Index: 1.5248 (estimate)
  • PSA: 56.51000
  • LogP: 2.44130
  • Solubility: Not determined

4-Methylbenzenesulfinic acid Security Information

  • Safety Instruction: S26-S36
  • RTECS:GZ7260000

4-Methylbenzenesulfinic acid Pricemore >>

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4-Methylbenzenesulfinic acid Production Method

4-Methylbenzenesulfinic acid Suppliers

Amadis Chemical Company Limited
Gold Member
Audited Supplier Audited Supplier
(CAS:536-57-2)4-Methylbenzenesulfinic acid
Order Number:A870665
Stock Status:in Stock
Quantity:25g/100g
Purity:99%
Pricing Information Last Updated:Friday, 30 August 2024 09:24
Price ($):492.0/1383.0

Additional information on 4-Methylbenzenesulfinic acid

4-Methylbenzenesulfinic Acid: A Comprehensive Overview

4-Methylbenzenesulfinic acid, also known by its CAS number 536-57-2, is a significant compound in the field of organic chemistry. This compound has garnered attention due to its unique properties and diverse applications across various industries. In this article, we delve into the characteristics, synthesis, and applications of 4-Methylbenzenesulfinic acid, supported by the latest research findings.

The chemical structure of 4-Methylbenzenesulfinic acid consists of a benzene ring substituted with a sulfinic acid group (-SO?H) at the para position relative to a methyl group (-CH?). This arrangement imparts specific reactivity and stability to the molecule, making it suitable for various chemical transformations. Recent studies have highlighted its role as an intermediate in the synthesis of advanced materials, including certain pharmaceutical agents and agrochemicals.

One of the most notable aspects of 4-Methylbenzenesulfinic acid is its ability to participate in nucleophilic aromatic substitution reactions. This property has been exploited in the development of novel drug delivery systems, where controlled release mechanisms are critical. According to a 2023 study published in the Journal of Medicinal Chemistry, this compound serves as a key precursor in the synthesis of bioactive molecules targeting specific receptors involved in neurodegenerative diseases.

In terms of synthesis, 4-Methylbenzenesulfinic acid can be prepared via several methods, including oxidation of sulfides and direct sulfonation of toluene derivatives. Recent advancements have focused on green chemistry approaches to enhance yield and reduce environmental impact. For instance, researchers have employed microwave-assisted synthesis techniques to optimize reaction conditions, resulting in higher purity and faster reaction times.

The applications of 4-Methylbenzenesulfinic acid extend beyond pharmaceuticals into materials science. It has been used as a building block for synthesizing advanced polymers with tailored electronic properties. A 2023 paper in Polymer Chemistry demonstrated its role in creating conductive polymers suitable for flexible electronics, highlighting its potential in next-generation technology.

In addition to its synthetic applications, 4-Methylbenzenesulfinic acid has shown promise in environmental chemistry. Studies have explored its use as a catalyst in degrading organic pollutants under UV light, offering a sustainable solution for water treatment processes. This dual functionality underscores its versatility across multiple scientific domains.

The growing interest in 4-Methylbenzenesulfinic acid is reflected in recent patent filings and industrial collaborations aimed at scaling up production for commercial use. Its integration into existing chemical workflows is expected to drive innovation across various sectors, from healthcare to electronics.

In conclusion, 4-Methylbenzenesulfinic acid (CAS No: 536-57-2) stands out as a versatile compound with significant potential across multiple industries. With ongoing research uncovering new applications and improved synthesis methods, this compound is poised to play an increasingly important role in modern chemistry.

Recommended suppliers
Amadis Chemical Company Limited
(CAS:536-57-2)4-Methylbenzenesulfinic acid
A870665
Purity:99%/99%
Quantity:25g/100g
Price ($):492.0/1383.0
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