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Methyldantoin

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Identification
Molecular formula
C18H24N2O3
CAS number
64091-91-4
IUPAC name
1-cyclohexyl-5-methyl-3-phenyl-hexahydropyrimidine-2,4,6-trione
State
State

At room temperature, Methyldantoin is a solid.

Melting point (Celsius)
219.00
Melting point (Kelvin)
492.00
Boiling point (Celsius)
400.00
Boiling point (Kelvin)
673.00
General information
Molecular weight
270.35g/mol
Molar mass
270.3520g/mol
Density
1.2893g/cm3
Appearence

Methyldantoin appears as a white crystalline solid. It is often provided in powder form and has a distinct crystalline structure under magnification.

Comment on solubility

Solubility Characteristics

The solubility of 1-cyclohexyl-5-methyl-3-phenyl-hexahydropyrimidine-2,4,6-trione can be influenced by a variety of factors, including its chemical structure and the solvent used.

Factors Affecting Solubility

  • Polarity: The presence of polar or non-polar groups in the compound significantly impacts its solubility. The cyclohexyl and the phenyl groups may contribute to hydrophobic properties, whereas the trione functional groups can enhance polar characteristics.
  • Temperature: Increasing temperature often enhances solubility for many organic compounds. Thus, higher temperatures may lead to better dissolution in suitable solvents.
  • Solvent Choice: Water, as a polar solvent, may show limited solubility due to the overall non-polar nature of the compound. On the other hand, non-polar or apolar solvents like ethanol or chloroform might facilitate better solubility.

General Observations

In general, we can summarize the expected solubility properties as follows:

  • Soluble: Possibly in non-polar solvents
  • Insoluble: Likely in water at room temperature

Understanding the solubility of this compound is crucial for its applications in chemical reactions, formulations, or other practical uses in the field of chemistry.

Interesting facts

Interesting Facts about 1-cyclohexyl-5-methyl-3-phenyl-hexahydropyrimidine-2,4,6-trione

This intriguing compound belongs to a class of chemical compounds known as pyrimidines, which are characterized by their fused ring structures containing nitrogen atoms. Its complex architecture allows for a multitude of fascinating properties and potential applications in various scientific fields.

Chemical Structure

The structure of 1-cyclohexyl-5-methyl-3-phenyl-hexahydropyrimidine-2,4,6-trione is notable for the following reasons:

  • Cyclic Components: The presence of a cyclohexyl group contributes to enhanced stability and unique steric effects, potentially affecting the compound's reactivity.
  • Substitution Variations: The addition of a phenyl group in the 3-position can significantly alter the electronic properties, making it an interesting candidate for study in medicinal chemistry.
  • Tautomerism: Pyrimidine-based compounds like this one often exhibit tautomeric forms, which can influence biological activity and stability.

Applications and Significance

This compound, with its rich framework, is of great interest for several reasons:

  • Pharmaceutical Potential: Pyrimidine derivatives play crucial roles in drug discovery due to their bioactivity and ability to bind with DNA and RNA. Compounds like this one may have applications in developing antimicrobial or antitumor agents.
  • Research in Organic Chemistry: Scientists are keen on synthesizing such compounds to explore reaction mechanisms, particularly regarding nucleophilic additions and electrophilic substitutions.
  • Polyfunctional Reagent: The trione functional groups can serve as versatile intermediates in organic syntheses, lending themselves to further transformations.

Conclusion

In summary, 1-cyclohexyl-5-methyl-3-phenyl-hexahydropyrimidine-2,4,6-trione exemplifies the complexity and diversity found in organic compounds. As you dive deeper into the world of chemistry, it becomes increasingly evident how such specialized compounds can pave the way for innovative solutions in pharmaceuticals and materials science. As the renowned chemist Linus Pauling famously said, "The best way to have a good idea is to have a lot of ideas." Exploring compounds like this is certainly part of that creative journey!

Synonyms
1-Cyclohexyl-5-methyl-3-phenylbarbituric acid
1038-85-3
1-cyclohexyl-5-methyl-3-phenyl-1,3-diazinane-2,4,6-trione
BRN 0895860
BARBITURIC ACID, 1-CYCLOHEXYL-5-METHYL-3-PHENYL-
1-Cyclohexyl-5-methyl-3-phenyl-2,4,6(1H,3H,5H)-pyrimidinetrione
DTXSID10908604