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(2,4-dinitro-6-sec-butyl-phenyl) methylsulfanylformate

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Identification
Molecular formula
C12H14N2O6S
IUPAC name
(2,4-dinitro-6-sec-butyl-phenyl) methylsulfanylformate
State
State

This compound is typically found in a solid state at room temperature. It is generally stable but should be handled with care due to the presence of nitro groups, which can make it reactive under certain conditions. It should be stored in a tightly sealed container to avoid moisture uptake.

Melting point (Celsius)
123.00
Melting point (Kelvin)
396.15
Boiling point (Celsius)
360.00
Boiling point (Kelvin)
633.15
General information
Molecular weight
299.34g/mol
Molar mass
299.3360g/mol
Density
1.3750g/cm3
Appearence

This compound appears as a yellow crystalline solid, characteristic of many dinitrophenyl derivatives. It may also have a slight grainy texture if observed under a microscope and is typically not soluble in water but may dissolve in organic solvents.

Comment on solubility

Solubility of (2,4-dinitro-6-sec-butyl-phenyl) methylsulfanylformate

The solubility of a compound often depends on its molecular structure and the interactions it can form with the solvent. For (2,4-dinitro-6-sec-butyl-phenyl) methylsulfanylformate, we must consider several key factors:

  • Polarity: This compound has both polar and non-polar characteristics due to the presence of nitro groups and an alkyl substituent. Generally, polar molecules tend to dissolve well in polar solvents, whereas non-polar molecules are better suited for non-polar solvents.
  • Functional Groups: The presence of the methylsulfanyl and formate functionalities suggests potential for hydrogen bonding, which may enhance solubility in polar solvents like water.
  • Temperature Effects: Solubility can also be temperature-dependent. Increasing the temperature may increase solubility for certain compounds, particularly those with significant endothermic dissolution processes.

Given these factors, it can be expected that (2,4-dinitro-6-sec-butyl-phenyl) methylsulfanylformate may exhibit moderate solubility in polar solvents such as methanol or acetone, while potentially having limited solubility in non-polar solvents. However, definitive solubility data would be required to provide a concrete conclusion.

In conclusion, the solubility of this compound is influenced by its unique structure, with the possibility of intermolecular interactions playing a significant role in its behavior in various solvents.

Interesting facts

Interesting Facts about (2,4-Dinitro-6-sec-butyl-phenyl) Methylsulfanylformate

(2,4-Dinitro-6-sec-butyl-phenyl) methylsulfanylformate is a compound that showcases an intriguing combination of functional groups and a complex structural framework, making it a subject of interest among chemists and researchers alike. Here are some fascinating insights into its properties and applications:

  • Multi-functional Group: This compound features a methylsulfanyl group and a formate moiety, highlighting its potential for reactivity and synthesis in various chemical processes.
  • Electrophilic Nature: The presence of nitro groups enhances the electrophilicity of the aromatic system, which makes the compound useful for further chemical modifications and reactions.
  • Applications in Agri-Chemicals: Due to its structural characteristics, it could find applications in the formulation of agrochemicals, contributing to pest management solutions.
  • Pharmaceutical Potential: The unique structure might inspire the development of new pharmaceutical agents, capitalizing on the biological activity associated with nitro groups.
  • Research Interest: Researchers are keen on exploring the compound's interactions and behaviors in various solvents, which can yield insights into solvation effects and dynamics.

As chemists delve deeper into the analysis and application of (2,4-Dinitro-6-sec-butyl-phenyl) methylsulfanylformate, they uncover valuable information that may lead to innovative advancements in synthetic chemistry and material science. This compound serves as a testament to the fascinating world of organic chemistry, where the complexity of structures can lead to innumerable possibilities.

Synonyms
Stauffer R-11259
5389-12-8
R-11259
ENT 27,366
NSC 190962
BRN 2174448
S-Methyl O-(2-(1-methylpropyl)-4,6-dinitrophenyl) carbonothioate
ENT 27366
CARBONIC ACID, THIO-, O-(2-sec-BUTYL-4,6-DINITROPHENYL) S-METHYL ESTER
Carbonothioic acid, S-methyl O-(2-(1-methylpropyl)-4,6-dinitrophenyl) ester
O-(2-sek.Butyl-4,6-dinitrofenyl)-S-methylester kyseliny thiouhlicite [Czech]
O-(2-sek.Butyl-4,6-dinitrofenyl)-S-methylester kyseliny thiouhlicite
DTXSID90968665
O-[2-(Butan-2-yl)-4,6-dinitrophenyl] S-methyl carbonothioate