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Hexobarbital

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Identification
Molecular formula
C12H18N2O3
CAS number
56-29-1
IUPAC name
1-cyclohexyl-5-hexyl-hexahydropyrimidine-2,4,6-trione
State
State

At room temperature, hexobarbital exists in the solid state as a crystalline powder.

Melting point (Celsius)
151.00
Melting point (Kelvin)
424.15
Boiling point (Celsius)
349.00
Boiling point (Kelvin)
622.15
General information
Molecular weight
226.29g/mol
Molar mass
226.3040g/mol
Density
1.1601g/cm3
Appearence

Hexobarbital typically appears as a white crystalline powder. It may be odorless or have a very slight odor.

Comment on solubility

Solubility of 1-cyclohexyl-5-hexyl-hexahydropyrimidine-2,4,6-trione

The solubility of 1-cyclohexyl-5-hexyl-hexahydropyrimidine-2,4,6-trione in various solvents can be quite intriguing. Understanding its solubility is essential for applications in pharmaceuticals, materials science, and chemical synthesis. Here are some key aspects to consider:

  • Polar vs. Nonpolar Solvents: This compound is characterized by its long hydrocarbon chains (cyclohexyl and hexyl groups), suggesting that it may have a higher solubility in nonpolar solvents, such as hexane or toluene, compared to polar solvents like water.
  • Hydrophobic Interactions: The presence of substantial hydrophobic regions due to the hydrocarbon portions can lead to strong solubility in organic solvents. These regions tend to interact favorably with other hydrophobic substances.
  • Temperature Dependency: Solubility may vary with temperature. As the temperature increases, solubility in certain organic solvents often enhances due to increased molecular motion.
  • pH Influence: If the compound possesses acidic or basic functionalities, its solubility can be impacted significantly by the pH of the solvent, with certain forms becoming more soluble under specific conditions.

To summarize, while 1-cyclohexyl-5-hexyl-hexahydropyrimidine-2,4,6-trione may demonstrate limited solubility in water, it is expected to be more soluble in nonpolar organic solvents. Further empirical tests would provide clearer insights into the precise solubility characteristics across various media.

Interesting facts

Interesting Facts about 1-Cyclohexyl-5-hexyl-hexahydropyrimidine-2,4,6-trione

The compound 1-cyclohexyl-5-hexyl-hexahydropyrimidine-2,4,6-trione is a fascinating example of a complex organic molecule with various applications in modern chemistry. Here are some noteworthy aspects of this compound:

Structural Features

  • Multi-Cyclic Structure: This compound contains a pyrimidine ring, which is significant in medicinal chemistry.
  • Functional Groups: The presence of multiple carbon chains and carbonyl groups adds to its chemical reactivity and versatility.

Applications

  • Pharmaceuticals: Compounds with similar structures are often explored for their biological activity, including potential therapeutic effects.
  • Research Utility: Its unique structure makes it a subject of study in the synthesis of new materials and as a reference compound in analytical chemistry.

Significance in Chemistry

The study of compounds like 1-cyclohexyl-5-hexyl-hexahydropyrimidine-2,4,6-trione contributes to our understanding of structure-activity relationships. This relationship is crucial in drug design, allowing chemists to predict how changes in molecular structure can affect biological activity.

Quote from a Chemist

As chemists often say, “The beauty of chemistry lies not just in the reactions, but in the intricate dance of atoms that create functional masterpieces.”

In Summary: This compound is a striking example of the rich landscape of organic chemistry, offering insights into structural complexity, potential applications, and the convergence of science and creativity.

Synonyms
1-Cyclohexyl-5-hexylbarbituric acid
4192-33-0
BRN 0757673
BARBITURIC ACID, 1-CYCLOHEXYL-5-HEXYL-
1-Cyclohexyl-5-hexyl-2,4,6(1H,3H,5H)-pyrimidinetrione
2,4,6(1H,3H,5H)-Pyrimidinetrione, 1-cyclohexyl-5-hexyl-
5-24-09-00160 (Beilstein Handbook Reference)
SCHEMBL1426501
DTXSID40962052
3-Cyclohexyl-5-hexyl-6-hydroxypyrimidine-2,4(3H,5H)-dione