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Hexobarbital

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

At room temperature, hexobarbital is in a solid state, typically available as a white crystalline powder.

Melting point (Celsius)
128.00
Melting point (Kelvin)
401.15
Boiling point (Celsius)
216.00
Boiling point (Kelvin)
489.15
General information
Molecular weight
226.28g/mol
Molar mass
226.2780g/mol
Density
1.1650g/cm3
Appearence

Hexobarbital is a white crystalline powder that is odorless. It may be associated with more colorless forms or distributed as a fine powdered solid.

Comment on solubility

Solubility of 5-cyclohexyl-1-(4-hydroxycyclohexyl)hexahydropyrimidine-2,4,6-trione

The solubility of 5-cyclohexyl-1-(4-hydroxycyclohexyl)hexahydropyrimidine-2,4,6-trione in various solvents can be described as follows:

  • Polar Solvents: This compound is likely to exhibit moderate solubility in polar solvents such as water, due to the presence of hydroxy groups that can engage in hydrogen bonding.
  • Non-Polar Solvents: It may show relatively higher solubility in organic non-polar solvents such as hexane or toluene, aligning with its hydrophobic cyclohexyl components.
  • Mixed Solvents: In mixed solvent systems, solubility may increase as the polar and non-polar characteristics of the compound interact favorably with the solvent molecules.

It is essential to consider that solubility can be impacted by factors such as:

  • Temperature: Increasing temperature often enhances solubility for many compounds.
  • pH Levels: The solubility may vary with changes in pH, especially for compounds with ionizable groups.
  • Presence of Salts: Adding salts can influence solubility through the "salting out" or "salting in" effects, depending on the specific ionic interactions involved.

In conclusion, while the solubility profile of 5-cyclohexyl-1-(4-hydroxycyclohexyl)hexahydropyrimidine-2,4,6-trione is expected to reflect the balance between its polar and non-polar functional groups, empirical testing is crucial for definitive solubility data.

Interesting facts

Interesting Facts about 5-Cyclohexyl-1-(4-hydroxycyclohexyl)hexahydropyrimidine-2,4,6-trione

5-Cyclohexyl-1-(4-hydroxycyclohexyl)hexahydropyrimidine-2,4,6-trione is a fascinating compound that combines unique structural properties with potential applications in various fields. Here are some intriguing aspects of this compound:

  • Complex Structure: This compound features a hexahydropyrimidine ring, which is a rare structural motif that provides interesting chemical reactivity due to the presence of multiple functional groups.
  • Hydroxy Substituents: The hydroxy groups on the cyclohexyl rings enhance the compound's solubility in polar solvents and can participate in hydrogen bonding, which may influence its biological activity.
  • Potential Biological Activity: Compounds with similar structures have been investigated for their effects on biological systems, suggesting that this compound may exhibit interesting pharmacological properties.
  • Synthetic Challenges: The synthesis of this compound requires specific reagents and reaction conditions that may present challenges, offering a valuable opportunity for organic chemists to refine their synthetic techniques.

As noted by many chemists in the field, "The interplay of the rigid structure with flexible substituents can lead to remarkable properties." The study of compounds like 5-Cyclohexyl-1-(4-hydroxycyclohexyl)hexahydropyrimidine-2,4,6-trione not only deepens our understanding of organic chemistry but also opens doors for innovations in drug design and material science.

Synonyms
5-Cyclohexyl-1-(4-hydroxycyclohexyl)barbituric acid
4102-02-7
BRN 0761541
DTXSID40961388
BARBITURIC ACID, 5-CYCLOHEXYL-1-(4-HYDROXYCYCLOHEXYL)-
5-Cyclohexyl-6-hydroxy-3-(4-hydroxycyclohexyl)pyrimidine-2,4(3H,5H)-dione