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N-benzyl-1-[(4-chloro-2-nitro-phenyl)methylsulfanyl]methanimidothioic acid

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Identification
Molecular formula
C15H13ClN2O2S2
CAS number
104404-17-3
IUPAC name
N-benzyl-1-[(4-chloro-2-nitro-phenyl)methylsulfanyl]methanimidothioic acid
State
State

At room temperature, the compound is a crystalline solid. It is usually handled in powder form for laboratory and industrial applications.

Melting point (Celsius)
162.00
Melting point (Kelvin)
435.15
Boiling point (Celsius)
370.00
Boiling point (Kelvin)
643.15
General information
Molecular weight
364.83g/mol
Molar mass
364.8300g/mol
Density
1.3400g/cm3
Appearence

N-benzyl-1-[(4-chloro-2-nitro-phenyl)methylsulfanyl]methanimidothioic acid appears as a yellow to orange crystalline solid. Its vivid coloration is primarily due to the nitro group, which often imparts a yellow hue to organic compounds. The solid's crystalline nature indicates well-defined geometric arrangements of its molecules.

Comment on solubility

Solubility of N-benzyl-1-[(4-chloro-2-nitro-phenyl)methylsulfanyl]methanimidothioic acid

The solubility of N-benzyl-1-[(4-chloro-2-nitro-phenyl)methylsulfanyl]methanimidothioic acid is shaped by several factors that derive from its specific chemical structure. This compound displays interesting characteristics due to the presence of a variety of functional groups that can influence its solubility in different solvents.

Key Factors Affecting Solubility:

  • Polarity: The presence of both polar and nonpolar groups in the structure can lead to varying solubility in polar and nonpolar solvents.
  • Hydrogen Bonding: The ability of the molecule to engage in hydrogen bonding can enhance solubility in water and other polar solvents.
  • Ionization: If the compound can ionize in solution, it may increase its solubility considerably.
  • Temperature: Typically, the solubility of most compounds increases with rising temperature, affecting how this compound dissolves.

For this specific compound, understanding the impact of these factors allows for a better prediction of solubility in various solvents. It is also essential to note that:

  1. The compound is likely to be more soluble in organic solvents due to its nonpolar benzyl moiety.
  2. Conversely, it might show limited solubility in aqueous solutions given the presence of bulky groups and potential hydrophobic interactions.

In summary, the solubility characteristics of N-benzyl-1-[(4-chloro-2-nitro-phenyl)methylsulfanyl]methanimidothioic acid are multifaceted and need to be evaluated in the context of the solvent system being used, highlighting the compound's intriguing chemical behavior in solution.

Interesting facts

Interesting Facts about N-benzyl-1-[(4-chloro-2-nitro-phenyl)methylsulfanyl]methanimidothioic acid

N-benzyl-1-[(4-chloro-2-nitro-phenyl)methylsulfanyl]methanimidothioic acid is a fascinating compound that highlights the intricate nature of organosulfur chemistry. As a scientist, exploring this compound brings several captivating aspects to light:

  • Diverse Applications: This compound is not just a simple chemical; it has potential roles in various fields including pharmaceuticals and agrochemicals. Compounds containing thioic acid groups have been recognized for their biological activity, making them subjects of intensive research.
  • Mechanism of Action: The presence of the nitro and chloro substituents introduces significant reactivity. These groups can enhance the biological activity by altering the electronic properties of the molecule, thus making it more effective against targeted biological systems.
  • Structural Complexity: With multiple functional groups, this compound exemplifies how modifying chemical structure can lead to diverse properties. The thioic acid component itself suggests potential for interesting interactions in a biological setting, challenging students to understand structure-activity relationships.
  • Research Interest: As scientists look for new therapeutic agents, compounds like N-benzyl-1-[(4-chloro-2-nitro-phenyl)methylsulfanyl]methanimidothioic acid are integral in the ongoing exploration of drug development.

Furthermore, examining this compound offers a deeper understanding of sulfur chemistry and its implications in biological systems. The exploration of its synthesis and its reactivity presents a wealth of knowledge for students and researchers, showing that even complex sounding compounds can provide rich insights into the world of chemistry.

This compound serves as a reminder of the elegance of chemical diversity and the multitude of pathways that can lead to potential innovation in medicine and beyond.