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Cyclohexylphenylpropylbarbituric acid

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Identification
Molecular formula
C19H26N2O3
CAS number
125-33-7
IUPAC name
1-cyclohexyl-3-phenyl-5-propyl-hexahydropyrimidine-2,4,6-trione
State
State
At room temperature, Cyclohexylphenylpropylbarbituric acid is a solid. Due to its crystalline nature, it may have a granular texture and maintains a stable form under normal conditions.
Melting point (Celsius)
158.50
Melting point (Kelvin)
431.65
Boiling point (Celsius)
364.00
Boiling point (Kelvin)
637.15
General information
Molecular weight
357.47g/mol
Molar mass
357.4700g/mol
Density
1.2450g/cm3
Appearence

Cyclohexylphenylpropylbarbituric acid typically appears as a crystalline solid. The crystals are usually white to off-white in color and can vary in opacity depending on purity and environmental factors like humidity.

Comment on solubility

Solubility of 1-Cyclohexyl-3-phenyl-5-propyl-hexahydropyrimidine-2,4,6-trione

The solubility of 1-cyclohexyl-3-phenyl-5-propyl-hexahydropyrimidine-2,4,6-trione is an intriguing subject, influenced by its complex molecular structure. Understanding the solubility characteristics of this compound can provide valuable insights into its potential applications in various fields, including pharmaceuticals and materials science.

Key Factors Influencing Solubility

  • Polarity: The balance between polar and non-polar groups in the molecule greatly affects solubility. The cyclohexyl and phenyl groups are generally hydrophobic, while the trione functional groups may impart some degree of hydrophilicity.
  • Hydrogen Bonding: The presence of carbonyl groups in the trione structure allows for potential hydrogen bonding with solvents, enhancing solubility in polar solvents like water.
  • Structure-Activity Relationship: The specific arrangement of functional groups can lead to varied solubility profiles in different solvents, which underlines the importance of studying compound interactions.

Generally, it can be stated that:

  1. In polar solvents, the solubility may be moderate due to potential interactions with the polar functional groups.
  2. In non-polar solvents, solubility could be higher, reflecting the hydrophobic character of the cyclohexyl and phenyl groups.
  3. Temperature can further influence solubility, with many complex compounds exhibiting increased solubility at elevated temperatures.

In conclusion, while there may not be extensive literature specifically detailing the solubility of 1-cyclohexyl-3-phenyl-5-propyl-hexahydropyrimidine-2,4,6-trione, it is essential to explore its solubility characteristics through empirical studies to fully understand its behavior in different solvents. This knowledge can significantly enhance its practical applications.

Interesting facts

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

1-cyclohexyl-3-phenyl-5-propyl-hexahydropyrimidine-2,4,6-trione is a fascinating compound that showcases the complex world of organic chemistry. Here are some intriguing insights:

  • Diverse Structure: This compound features a unique hexahydropyrimidine framework, which is rich in nitrogen atoms and contributes to the compound's biological activity.
  • Pharmacological Potential: Many compounds with similar structures are investigated for their medicinal properties. They may serve as potential candidates for drug design, particularly in treating various diseases.
  • Substituent Influence: The cyclohexyl, phenyl, and propyl groups attached to the pyrimidine core can greatly influence the compound's chemical properties and reactivity, making it a subject of interest for synthetic chemists.
  • Environmental Context: Understanding compounds like this one can help researchers explore their metabolism and degradation in biological and environmental systems, contributing to green chemistry initiatives.
  • Analytical Studies: Many experimental techniques such as NMR spectroscopy, mass spectrometry, and X-ray crystallography are employed to elucidate the structure and dynamics of such compounds.

As stated by chemist John W. Moore, "In chemistry, the structure of a compound is the key to interpreting its reactivity and biological significance." This statement holds particularly true for 1-cyclohexyl-3-phenyl-5-propyl-hexahydropyrimidine-2,4,6-trione, making it a noteworthy subject of study in modern organic chemistry.

Synonyms
1-Cyclohexyl-3-phenyl-5-propylbarbituric acid
1045-96-1
1-cyclohexyl-3-phenyl-5-propyl-1,3-diazinane-2,4,6-trione
BRN 0897590
BARBITURIC ACID, 1-CYCLOHEXYL-3-PHENYL-5-PROPYL-
1-Cyclohexyl-3-phenyl-5-propyl-2,4,6(1H,3H,5H)-pyrimidinetrione
DTXSID10909010