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Bromacil Sodium

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Identification
Molecular formula
C9H12BrN2NaO3
CAS number
53404-19-6
IUPAC name
sodium;5-(2-bromoallyl)-4,6-dioxo-5-sec-butyl-1H-pyrimidin-2-olate
State
State

At room temperature, Bromacil Sodium is typically found in a solid state.

Melting point (Celsius)
158.00
Melting point (Kelvin)
431.00
Boiling point (Celsius)
0.00
Boiling point (Kelvin)
0.00
General information
Molecular weight
315.15g/mol
Molar mass
315.1500g/mol
Density
1.7500g/cm3
Appearence

Bromacil Sodium appears as a white to tan powder.

Comment on solubility

Solubility of Sodium 5-(2-bromoallyl)-4,6-dioxo-5-sec-butyl-1H-pyrimidin-2-olate

The solubility of sodium 5-(2-bromoallyl)-4,6-dioxo-5-sec-butyl-1H-pyrimidin-2-olate can be discussed in terms of its characteristics and behavior in various solvents.

Factors Influencing Solubility

Several factors may influence the solubility of this compound:

  • Polarity: The presence of polar functional groups in the compound aids its solubility in polar solvents like water, whereas the non-polar sec-butyl group may lead to lower solubility in non-polar solvents.
  • Hydrogen Bonding: The potential for hydrogen bonding with water molecules can enhance solubility.
  • Temperature: Generally, increasing temperature can increase solubility for many ionic compounds.

Expected Behavior

Given the structure of the compound, one might expect:

  • A reasonable solubility in water due to the sodium ion, which typically improves ionic solubility.
  • Potential solubility in organic solvents such as ethanol or DMSO due to the presence of both polar and non-polar regions.

In summary, the solubility of sodium 5-(2-bromoallyl)-4,6-dioxo-5-sec-butyl-1H-pyrimidin-2-olate is likely moderate to high in polar solvents, influenced by its ionic nature and molecular structure. Further empirical testing would be required to accurately determine specific solubility values in various solvents.

Interesting facts

Interesting Facts about Sodium; 5-(2-bromoallyl)-4,6-dioxo-5-sec-butyl-1H-pyrimidin-2-olate

This compound is a fascinating member of the pyrimidine family, which contributes to numerous biochemical applications and organic synthesis methodologies. Here are some noteworthy aspects:

  • Structural Complexity: The presence of a pyrimidine ring, along with a bromoallyl side chain, makes this compound quite unique. The intricate design can lead to interesting reactivity profiles in synthetic chemistry.
  • Biological Relevance: Pyrimidine derivatives are essential in biological systems as they form key components of nucleic acids—DNA and RNA. They play vital roles in processes such as protein synthesis and cellular metabolism.
  • Reactivity: The bromine atom introduces significant reactivity, making it a suitable candidate for further reactions like nucleophilic substitutions, which can be valuable in drug development.
  • Applications: This compound can be explored for its potential use in pharmaceuticals, particularly as a lead compound in the design of anti-cancer agents and other therapeutics.
  • Research Opportunities: The diverse functionalities provide a platform for research into new chemical reactions, particularly in the development of environmentally friendly synthetic pathways.

In the words of a well-known chemist, "Innovation in chemistry often lies at the intersection of elegance and complexity." The study of this compound exemplifies how intricate structures can yield wide-ranging applications and lead to the advancement of science.

Overall, sodium; 5-(2-bromoallyl)-4,6-dioxo-5-sec-butyl-1H-pyrimidin-2-olate embodies the exciting intersection of synthetic organic chemistry and medicinal applications, offering enticing avenues for exploration and discovery.