Cas no 1035996-09-8 (Propanoic acid, 2-[[(ethylthio)thioxomethyl]thio]-)

Propanoic acid, 2-[[(ethylthio)thioxomethyl]thio]- structure
1035996-09-8 structure
Product Name:Propanoic acid, 2-[[(ethylthio)thioxomethyl]thio]-
CAS No:1035996-09-8
MF:C6H10O2S3
MW:210.337398052216
CID:4477450
PubChem ID:88933341
Update Time:2025-07-17

Propanoic acid, 2-[[(ethylthio)thioxomethyl]thio]- Chemical and Physical Properties

Names and Identifiers

    • Propanoic acid, 2-[[(ethylthio)thioxomethyl]thio]-
    • 2-{[(ethylsulfanyl)methanethioyl]sulfanyl}propanoic acid
    • EN300-7736607
    • 2-(((ethylsulfanyl)methanethioyl)sulfanyl)propanoic acid
    • 2-(((Ethylthio)carbonothioyl)thio)propanoic acid
    • 1035996-09-8
    • 2-(ethylsulfanylthiocarbonylsulfanyl)propionic acid
    • 866-895-2
    • SCHEMBL12548837
    • KRB99609
    • Inchi: 1S/C6H10O2S3/c1-3-10-6(9)11-4(2)5(7)8/h4H,3H2,1-2H3,(H,7,8)
    • InChI Key: WRYYRWJWFQIMSN-UHFFFAOYSA-N
    • SMILES: C(O)(=O)C(SC(SCC)=S)C

Computed Properties

  • Exact Mass: 209.98429308Da
  • Monoisotopic Mass: 209.98429308Da
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 5
  • Heavy Atom Count: 11
  • Rotatable Bond Count: 5
  • Complexity: 158
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 1
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 2.6
  • Topological Polar Surface Area: 120?2

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Propanoic acid, 2-[[(ethylthio)thioxomethyl]thio]- Related Literature

Additional information on Propanoic acid, 2-[[(ethylthio)thioxomethyl]thio]-

Comprehensive Overview of Propanoic acid, 2-[[(ethylthio)thioxomethyl]thio]- (CAS No. 1035996-09-8)

Propanoic acid, 2-[[(ethylthio)thioxomethyl]thio]- (CAS No. 1035996-09-8) is a specialized organic compound that has garnered significant attention in recent years due to its unique chemical properties and potential applications. This compound, characterized by its sulfur-containing functional groups, is often studied for its role in organic synthesis and material science. Researchers and industry professionals are increasingly interested in its molecular structure and reactivity, which make it a valuable intermediate in the production of advanced materials.

The compound's IUPAC name reflects its complex structure, featuring a propanoic acid backbone modified with thioester and thioxomethyl groups. These functional groups contribute to its versatile chemical behavior, enabling it to participate in various catalytic reactions and polymerization processes. In the context of green chemistry, Propanoic acid, 2-[[(ethylthio)thioxomethyl]thio]- is being explored as a potential eco-friendly alternative to traditional reagents, aligning with the global push for sustainable industrial practices.

One of the most frequently searched questions about this compound is its solubility and stability under different conditions. Studies indicate that it exhibits moderate solubility in polar organic solvents such as dimethyl sulfoxide (DMSO) and acetone, while remaining relatively stable at room temperature. This makes it suitable for use in laboratory settings and industrial applications where controlled environments are essential. Additionally, its thermal stability has been a topic of interest, particularly for applications requiring high-temperature resistance.

Another area of growing interest is the compound's potential role in pharmaceutical research. While not directly used as an active pharmaceutical ingredient (API), its derivatives have shown promise in drug development, particularly in the synthesis of sulfur-containing heterocycles. These structures are often key components in antibiotics and antiviral agents, making Propanoic acid, 2-[[(ethylthio)thioxomethyl]thio]- a valuable building block in medicinal chemistry.

From an SEO perspective, users often search for terms like "CAS 1035996-09-8 supplier," "Propanoic acid derivatives," and "thioester applications." These queries reflect the compound's relevance in both academic research and industrial manufacturing. To address these search intents, it's important to highlight the compound's commercial availability and technical specifications, which are critical for procurement decisions. Suppliers typically provide detailed safety data sheets (SDS) and analytical certificates to ensure compliance with regulatory standards.

In the field of material science, Propanoic acid, 2-[[(ethylthio)thioxomethyl]thio]- is being investigated for its potential to modify polymer properties. Its ability to introduce sulfur linkages into polymer chains can enhance mechanical strength and chemical resistance, making it a candidate for high-performance materials. This aligns with the increasing demand for advanced composites in industries such as aerospace and automotive.

Finally, the compound's spectroscopic data (e.g., NMR, IR, and mass spectrometry) is frequently requested by researchers for structural verification and purity assessment. These analytical techniques are essential for ensuring the compound's suitability for specific applications. As the scientific community continues to explore its potential, Propanoic acid, 2-[[(ethylthio)thioxomethyl]thio]- remains a subject of ongoing research and development.

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