Iodouracil-modified alanine | Solubility of Things

Identification

Molecular formula

C₇H₈IN₃O₄

CAS number

66045-53-6

IUPAC name

2-amino-3-(5-iodo-2,4-dioxo-pyrimidin-1-yl)propanoic acid

State

At room temperature, the compound is in a solid state. This solid is typically stable under standard conditions and may require specific storage conditions to prevent degradation, given its potential sensitivity to light and moisture.

Melting point (Celsius)

232.00

Melting point (Kelvin)

505.15

Boiling point (Celsius)

360.00

Boiling point (Kelvin)

633.15

General information

Molecular weight

297.10g/mol

Molar mass

297.0970g/mol

Density

2.1100g/cm³

Appearence

The compound typically appears as a crystalline solid, which can be white or off-white in color. Its crystal structure is characterized by the presence of aromatic rings that contribute to its unique stacking and arrangement. The presence of iodine can introduce a slight beige or yellow tint to the compound.

Comment on solubility

Solubility of 2-amino-3-(5-iodo-2,4-dioxo-pyrimidin-1-yl)propanoic acid

The compound 2-amino-3-(5-iodo-2,4-dioxo-pyrimidin-1-yl)propanoic acid, with the chemical formula C₇H₈IN₃O₄, exhibits notable solubility characteristics that are of significant interest in various chemical and biological contexts.

Solubility Characteristics

Aqueous Solubility: This compound is expected to be soluble in water due to the presence of amino and carboxylic acid functional groups, which can form hydrogen bonds with water molecules.
Polar Solvents: Solubility may also be observed in polar organic solvents, further influenced by the iodinated pyrimidine moiety.
Non-Polar Solvents: Limited solubility is anticipated in non-polar solvents due to the polar nature of its functional groups.

As a general rule, compounds that incorporate amino acids have enhanced solubility in water, a trend that holds true here. However, the presence of heavier halogens like iodine can introduce steric hindrance, potentially influencing solubility dynamics.

Key Points to Consider

While solubility can indicate interaction potential in biological systems, it is correlated with both molecular structure and solvent properties.
Environmental factors such as temperature and pH may further influence solubility, where increased temperatures often improve solubility.
In pharmaceutical applications, understanding the solubility of this compound is crucial for formulation development and bioavailability assessments.

Overall, the solubility profile of 2-amino-3-(5-iodo-2,4-dioxo-pyrimidin-1-yl)propanoic acid exemplifies the intricate balance between structural characteristics and solvation properties.

Interesting facts

Interesting Facts about 2-amino-3-(5-iodo-2,4-dioxo-pyrimidin-1-yl)propanoic acid

2-amino-3-(5-iodo-2,4-dioxo-pyrimidin-1-yl)propanoic acid is a fascinating compound that sits at the intersection of amino acids and nucleotide derivatives. As a chemical scientist or chemistry student, you'll appreciate the following intriguing aspects of this compound:

Biological Relevance: This compound contains a pyrimidine ring, a core structure found in several essential biological molecules such as nucleic acids (DNA and RNA) and various coenzymes.
Halogen Influence: The presence of iodine is particularly noteworthy. Iodinated compounds have been studied for their role in medicinal chemistry, especially in drug development. Iodine can enhance biological activity, making this compound a potential candidate for pharmacological research.
Structural Diversity: The coexistence of amino acid properties with a pyrimidine structure creates a unique blend of functionalities, allowing for interesting interactions in biological systems, potentially impacting enzyme activity and metabolic pathways.
Synthetic Pathways: The synthesis of this compound could involve various chemical methodologies, including functionalization of existing pyrimidine structures or amination techniques, which can be an excellent exercise for students learning synthetic organic chemistry.
Applications in Medicine: Research into compounds like this one could lead to advancements in therapies targeting various diseases, such as cancer and viral infections, where both amino acids and nucleic acid analogs play significant roles.

In summary, 2-amino-3-(5-iodo-2,4-dioxo-pyrimidin-1-yl)propanoic acid serves as a remarkable example of how structural modifications can lead to compounds with unique biological and medicinal properties. As quoted by a renowned chemist, “The beauty of chemistry lies in its ability to create new possibilities by simply adjusting the molecular framework." This sentiment holds true for our compound, inviting further exploration into its potential!