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N-[2-(3,4-diethoxyphenyl)ethyl]-1-ethoxycarbonylsulfanyl-methanimidothioic acid

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Identification
Molecular formula
C17H24N2O4S2
CAS number
1149609-27-5
IUPAC name
N-[2-(3,4-diethoxyphenyl)ethyl]-1-ethoxycarbonylsulfanyl-methanimidothioic acid
State
State

At room temperature, N-[2-(3,4-diethoxyphenyl)ethyl]-1-ethoxycarbonylsulfanyl-methanimidothioic acid typically exists in a solid crystalline state. It is stable under standard storage conditions, although care should be taken to avoid exposure to excessive heat or light that could lead to degradation.

Melting point (Celsius)
168.50
Melting point (Kelvin)
441.65
Boiling point (Celsius)
420.50
Boiling point (Kelvin)
693.65
General information
Molecular weight
371.50g/mol
Molar mass
371.5020g/mol
Density
1.2495g/cm3
Appearence

N-[2-(3,4-diethoxyphenyl)ethyl]-1-ethoxycarbonylsulfanyl-methanimidothioic acid is a crystalline solid compound that appears as fine, off-white to pale yellow powder. Its crystals may vary in size and structure depending on the synthesis and purification processes involved. The compound may exhibit slight hygroscopic tendencies due to the presence of multiple ethoxy groups, which could absorb moisture from the air.

Comment on solubility

Solubility of N-[2-(3,4-diethoxyphenyl)ethyl]-1-ethoxycarbonylsulfanyl-methanimidothioic acid

The solubility of N-[2-(3,4-diethoxyphenyl)ethyl]-1-ethoxycarbonylsulfanyl-methanimidothioic acid can be quite complex due to its intricate structure. Understanding its solubility involves considering several factors:

  • Polarity: Compounds with significant polarity often exhibit better solubility in polar solvents, while non-polar solvents are more suited for non-polar compounds. This compound features multiple functional groups that can contribute to its polarity.
  • Hydrogen Bonding: The presence of functional groups that can form hydrogen bonds, such as the -COOH group, can enhance solubility in water and other polar solvents.
  • Temperature Effects: Solubility typically increases with temperature for many solids. Thus, the compound's solubility may improve when dissolved in warm solvents.
  • pH Influence: The solubility of acid-based compounds is often pH-dependent. In acidic environments, this compound may exist in a more soluble form.

In summary, N-[2-(3,4-diethoxyphenyl)ethyl]-1-ethoxycarbonylsulfanyl-methanimidothioic acid's solubility can vary widely based on the solvent choice and environmental conditions. It is essential to conduct systematic testing in various solvents and conditions to comprehend its solubility profile fully. As with many chemicals, “solubility is a reflection of both structure and environment.”

Interesting facts

Interesting Facts about N-[2-(3,4-diethoxyphenyl)ethyl]-1-ethoxycarbonylsulfanyl-methanimidothioic acid

This compound showcases the intricate world of organic chemistry, particularly in the realm of thioacids and their derivatives. Here are some fascinating insights:

  • Functional Diversity: The presence of both ethoxy groups and a sulfenamide linkage provides this compound with a rich tapestry of chemical reactivity, allowing for potential applications in pharmaceuticals and agrochemicals.
  • Catalytic Potential: Compounds that feature thioamide functionalities often demonstrate unique catalytic properties. This compound could potentially serve as a catalyst in various organic reactions due to the polarization of the S-N bond.
  • Biological Relevance: Research suggests that compounds with structural similarities to this compound can exhibit antifungal and antibacterial properties. This raises intriguing possibilities for the development of new medicinal agents.
  • Structural Complexity: The multi-functional nature of the compound, integrating ester, thioester, and thioamide components, highlights the complexity and beauty of organic synthesis. Each element in its structure contributes to its overall stability and reactivity.
  • Historical Context: The study of thioacids can be traced back to the early 20th century. They have become essential in synthetic organic chemistry, providing pathways to synthesize larger and more complex molecules.

As a scientist, it’s thrilling to explore compounds like this one that sit at the crossroads of synthetic versatility and biological function. The future is ripe for discovery!