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Barbituric acid derivative

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Identification
Molecular formula
C10H16N2O3
CAS number
77-26-9
IUPAC name
5-ethyl-1,3-dimethyl-hexahydropyrimidine-2,4,6-trione
State
State

At room temperature, it is in a solid state typically as crystalline powder.

Melting point (Celsius)
155.00
Melting point (Kelvin)
428.15
Boiling point (Celsius)
400.00
Boiling point (Kelvin)
673.15
General information
Molecular weight
198.25g/mol
Molar mass
198.2470g/mol
Density
1.2000g/cm3
Appearence

This compound typically appears as a white crystalline solid. It is odorless or may have a very faint characteristic odor.

Comment on solubility

Solubility of 5-ethyl-1,3-dimethyl-hexahydropyrimidine-2,4,6-trione

The solubility of 5-ethyl-1,3-dimethyl-hexahydropyrimidine-2,4,6-trione is an intriguing topic due to its complex structural characteristics. Being a pyrimidine derivative, this compound exhibits unique solubility behavior that can be influenced by several factors, including:

  • Polarity: The presence of multiple functional groups can enhance solubility in polar solvents.
  • Hydrogen Bonding: The ability of this compound to participate in hydrogen bonding with solvents like water may increase its solubility.
  • Temperature: Solubility can often be temperature-dependent; increasing temperature can lead to higher solubility in many instances.

Generally, pyrimidine derivatives are known to show varying solubility in common solvents:

  • Water: Possibly soluble due to polar characteristics, although specific solubility data may need to be referenced.
  • Alcohols: Likely to exhibit good solubility in alcohols like ethanol or methanol.
  • Organic Solvents: May also dissolve well in non-polar organic solvents, depending on the specific substituents.

In summary, while the explicit solubility data for 5-ethyl-1,3-dimethyl-hexahydropyrimidine-2,4,6-trione may vary, understanding its interaction with various solvents can provide valuable insights into its potential applications and effectiveness in different environments. As this compound interacts with solvents, it’s crucial to consider the structural aspects that govern its solubility behavior.

Interesting facts

Interesting Facts about 5-Ethyl-1,3-dimethyl-hexahydropyrimidine-2,4,6-trione

5-Ethyl-1,3-dimethyl-hexahydropyrimidine-2,4,6-trione is an intriguing compound in the realm of organic chemistry, primarily noted for its unique structural properties and potential applications. Here are some interesting insights:

  • Structural Uniqueness: The hexahydropyrimidine structure of this compound features a saturated six-membered ring that contributes to its reactivity and chemical behavior, making it a subject of study in medicinal chemistry.
  • Biological Activity: Compounds with a similar structure often exhibit biological significance. Research has suggested that derivatives of pyrimidine have potential as antiviral, antitumor, and anti-inflammatory agents, which may indicate that our compound could also possess similar biological activities.
  • Synthetic Pathways: The synthesis of hexahydropyrimidine derivatives is a fascinating topic in organic synthesis. Various methods, including cyclization reactions, can be employed to create this compound, showcasing the creativity of chemists in manipulating small molecules.
  • Application in Agriculture: Some pyrimidine derivatives are known to serve as crucial intermediates in the synthesis of herbicides and pesticides. Exploring the agricultural applications of this compound can lead to enhanced crop protection methods.
  • Characterization Techniques: Understanding the properties of 5-Ethyl-1,3-dimethyl-hexahydropyrimidine-2,4,6-trione requires advanced characterization techniques such as NMR (Nuclear Magnetic Resonance), HPLC (High-Performance Liquid Chromatography), and mass spectrometry. These techniques allow scientists to elucidate the compound's structure and purity.
  • Interdisciplinary Research: The study of such compounds often intersects with fields such as pharmacology and toxicology, providing a rich ground for interdisciplinary collaboration in research, which can foster innovations in drug development.

Overall, 5-ethyl-1,3-dimethyl-hexahydropyrimidine-2,4,6-trione is not only a compound of chemical interest, but it also opens doors to practical applications that bridge science and everyday life. Its study exemplifies the blend of creativity and precision that defines modern chemistry.

Synonyms
1,3-Dimethyl-5-ethylbarbituric acid
5-Ethyl-1,3-dimethylbarbituric acid
Barbituric acid, 1,3-dimethyl-5-ethyl-
Barbituric acid, 5-ethyl-1,3-dimethyl-
EINECS 230-980-7
NSC 128099
2,4,6(1H,3H,5H)-Pyrimidinetrione, 5-ethyl-1,3-dimethyl-
BRN 0175019
57V098SX0D
NSC-128099
UNII-57V098SX0D
DTXSID40224501
5-24-09-00121 (Beilstein Handbook Reference)
5-Ethyl-1,3-dimethyl-2,4,6(1H,3H,5H)-pyrimidinetrione
DTXCID00146992
Barbituric acid, 5-ethyl-1,3-dimethyl-(8CI)
2,4,6(1H,3H,5H)-Pyrimidinetrione, 5-ethyl-1,3-dimethyl-(9CI)
qbcqxndnmohqiu-uhfffaoysa-n
7391-61-9
NSC128099
SCHEMBL1263716
Barbituric acid,3-dimethyl-5-ethyl-
1,3-dimethyl-5-ethyl-barbituric acid
NS00037572
2,6(1H,3H,5H)-Pyrimidinetrione, 5-ethyl-1,3-dimethyl-
5-Ethyl-1,3-dimethyl-2,4,6(1H,3H,5H)-pyrimidinetrione #