Cas no 117341-28-3 (2-(2-bromophenyl)sulfanylethanol)

2-(2-Bromophenyl)sulfanylethanol is a brominated aromatic thioether alcohol with the molecular formula C?H?BrOS. This compound features a phenyl ring substituted with a bromine atom at the ortho position, linked to a hydroxyethylthio group. Its structural properties make it a versatile intermediate in organic synthesis, particularly for constructing sulfur-containing heterocycles or as a precursor in pharmaceutical and agrochemical applications. The presence of both a thioether and hydroxyl group allows for further functionalization, enabling selective modifications. Its stability under standard conditions and well-defined reactivity profile enhance its utility in controlled synthetic pathways. Suitable for use in research and industrial settings requiring precise sulfur-based building blocks.
2-(2-bromophenyl)sulfanylethanol structure
117341-28-3 structure
Product Name:2-(2-bromophenyl)sulfanylethanol
CAS No:117341-28-3
MF:C8H9BrOS
MW:233.125460386276
CID:1206833
PubChem ID:2757168
Update Time:2025-11-02

2-(2-bromophenyl)sulfanylethanol Chemical and Physical Properties

Names and Identifiers

    • 2-(2-bromophenyl)sulfanylethanol
    • 2-bromobenzene
    • 2-(2-bromophenylthio)ethan-1-ol
    • AC1MBV8S
    • 2-BROMOPHENYLTHIOETHANOL
    • 2-(2-bromophenylthio)ethanol
    • Z149386602
    • AKOS009076590
    • 2-[(2-bromophenyl)sulfanyl]ethan-1-ol
    • ST51041982
    • 117341-28-3
    • DTXSID10373752
    • G62273
    • MDL: MFCD03789139
    • Inchi: 1S/C8H9BrOS/c9-7-3-1-2-4-8(7)11-6-5-10/h1-4,10H,5-6H2
    • InChI Key: IQSSYWVFPQBQLS-UHFFFAOYSA-N
    • SMILES: BrC1C=CC=CC=1SCCO

Computed Properties

  • Exact Mass: 231.95600
  • Monoisotopic Mass: 231.95575g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 1
  • Heavy Atom Count: 11
  • Rotatable Bond Count: 3
  • Complexity: 110
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 2.4
  • Topological Polar Surface Area: 45.5?2

Experimental Properties

  • PSA: 45.53000
  • LogP: 2.53350

2-(2-bromophenyl)sulfanylethanol Customs Data

  • HS CODE:2930909090
  • Customs Data:

    China Customs Code:

    2930909090

    Overview:

    2930909090. Other organic sulfur compounds. VAT:17.0%. Tax refund rate:13.0%. Regulatory conditions:nothing. MFN tariff:6.5%. general tariff:30.0%

    Declaration elements:

    Product Name, component content, use to

    Summary:

    2930909090. other organo-sulphur compounds. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:30.0%

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Additional information on 2-(2-bromophenyl)sulfanylethanol

Comprehensive Guide to 2-(2-Bromophenyl)sulfanylethanol (CAS No. 117341-28-3): Properties, Applications, and Market Insights

2-(2-Bromophenyl)sulfanylethanol (CAS No. 117341-28-3) is a specialized organic compound with a unique molecular structure that combines a brominated phenyl ring with a sulfanylethanol group. This compound has garnered significant attention in recent years due to its versatile applications in pharmaceuticals, agrochemicals, and material science. Researchers and industry professionals frequently search for terms like "2-(2-bromophenyl)sulfanylethanol synthesis," "CAS 117341-28-3 uses," and "bromophenyl sulfanylethanol properties," highlighting its growing relevance in scientific and industrial communities.

The molecular formula of 2-(2-Bromophenyl)sulfanylethanol is C8H9BrOS, with a molecular weight of 233.12 g/mol. Its structure features a bromine atom at the ortho position of the phenyl ring, which enhances its reactivity in various chemical transformations. The sulfanylethanol moiety contributes to its solubility in polar solvents, making it a valuable intermediate in organic synthesis. Recent studies have explored its potential as a building block for pharmaceutical intermediates, particularly in the development of novel therapeutic agents targeting inflammatory diseases and metabolic disorders.

One of the most searched questions about this compound is "How is 2-(2-bromophenyl)sulfanylethanol used in drug discovery?" The answer lies in its ability to serve as a key precursor for biologically active molecules. For instance, it has been employed in the synthesis of sulfur-containing heterocycles, which are prominent scaffolds in many FDA-approved drugs. Additionally, its bromine substituent offers a handle for further functionalization via cross-coupling reactions, a topic frequently discussed in modern green chemistry forums.

In material science, 2-(2-Bromophenyl)sulfanylethanol has shown promise in the development of advanced polymers and liquid crystals. Its incorporation into polymer chains can enhance thermal stability and optical properties, making it relevant for applications in OLED technology and flexible electronics—two trending topics in materials research. Industry reports indicate a growing demand for this compound in Asia-Pacific markets, driven by expansions in the electronics and healthcare sectors.

From a safety perspective, proper handling of CAS 117341-28-3 requires standard laboratory precautions. While not classified as hazardous under most regulatory frameworks, its brominated aromatic nature warrants careful consideration in environmental discharge scenarios. This aligns with current industry focus on sustainable chemical practices and waste reduction, as evidenced by numerous queries about "eco-friendly disposal of brominated compounds."

The synthesis of 2-(2-Bromophenyl)sulfanylethanol typically involves the reaction of 2-bromothiophenol with ethylene oxide or related reagents. Recent patent literature describes improved catalytic methods that reduce energy consumption—a response to the chemical industry's push toward energy-efficient processes. Analytical characterization is commonly performed via NMR spectroscopy and mass spectrometry, techniques frequently mentioned in academic search trends.

Market analysis reveals that the price trajectory of 117341-28-3 has remained stable, with occasional fluctuations tied to bromine feedstock availability. Suppliers increasingly highlight its high purity grades (≥98%) to meet pharmaceutical industry standards. The compound's storage stability under inert atmospheres and its compatibility with common organic solvents make it a practical choice for industrial-scale applications.

Emerging research directions for 2-(2-bromophenyl)sulfanylethanol derivatives include their potential as corrosion inhibitors and photocatalysts—areas gaining traction in materials science publications. These applications leverage the compound's electron-rich aromatic system and chelating ability, properties that are actively investigated in nanotechnology applications.

For researchers seeking 2-(2-Bromophenyl)sulfanylethanol suppliers, verification of certificates of analysis and regulatory compliance documents is essential. The compound's technical data sheets typically specify parameters like melting point (reported range 45-48°C) and boiling point (decomposes before boiling at atmospheric pressure), which are critical for process design.

In conclusion, 2-(2-Bromophenyl)sulfanylethanol represents a multifaceted chemical building block with expanding applications across scientific disciplines. Its combination of structural features and synthetic versatility positions it as a compound of enduring interest in both academic and industrial settings. Future developments may reveal additional utilities for this molecule, particularly in cutting-edge fields like bioconjugation chemistry and smart materials engineering.

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