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2'-Deoxythymidine 5'-(dihydrogen phosphate)

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Identification
Molecular formula
C9H15N2O8P
CAS number
10049-83-9
IUPAC name
[2-aminoethoxy(hydroxy)phosphoryl] [5-(4-amino-2-oxo-pyrimidin-1-yl)-3,4-dihydroxy-tetrahydrofuran-2-yl]methyl hydrogen phosphate
State
State

At room temperature, the compound is a solid.

Melting point (Celsius)
189.00
Melting point (Kelvin)
462.15
Boiling point (Celsius)
342.00
Boiling point (Kelvin)
615.15
General information
Molecular weight
402.18g/mol
Molar mass
402.1810g/mol
Density
2.2900g/cm3
Appearence

The compound appears as a white crystalline powder.

Comment on solubility

Solubility of [2-aminoethoxy(hydroxy)phosphoryl] [5-(4-amino-2-oxo-pyrimidin-1-yl)-3,4-dihydroxy-tetrahydrofuran-2-yl]methyl hydrogen phosphate (C9H15N2O8P)

The solubility characteristics of the compound [2-aminoethoxy(hydroxy)phosphoryl] [5-(4-amino-2-oxo-pyrimidin-1-yl)-3,4-dihydroxy-tetrahydrofuran-2-yl]methyl hydrogen phosphate can be quite intriguing due to its intricate molecular structure. Several key factors influence its solubility:

  • Polarity: This compound exhibits notable polarity attributed to the presence of numerous functional groups such as amino, hydroxyl, and phosphate groups, likely leading to *higher solubility in polar solvents* like water.
  • Hydrogen Bonding: The ability to form *hydrogen bonds* between the hydroxyl groups and water molecules enhances its solubility.
  • Ionization: Phosphate moieties can exist in an ionized form under physiological conditions, contributing to its *solubility profile in biological systems*.
  • Temperature Dependency: Like many compounds, its solubility may increase with temperature, but this requires empirical data for confirmation.

In summary, while the exact solubility parameters necessitate specific testing, the factors mentioned above suggest that this compound is likely to dissolve well in aqueous environments, particularly those rich in solvent interactions. As noted, "A compound's solubility is its inherent ability to blend with solvents, determined by its structural characteristics and medium." Therefore, further studies would be essential to conclusively establish its solubility quantitative measures.

Interesting facts

Interesting Facts about [2-aminoethoxy(hydroxy)phosphoryl] [5-(4-amino-2-oxo-pyrimidin-1-yl)-3,4-dihydroxy-tetrahydrofuran-2-yl]methyl hydrogen phosphate

This compound is a fascinating example of organic phosphorus chemistry and exhibits potential biological significance. It encapsulates a harmonious blend of both amino acids and nucleoside derivatives, which piques the interest of many chemists and biochemists alike.

Key Features

  • Biological Relevance: The presence of pyrimidine and amino functionalities suggests potential roles in nucleotide metabolism and biological pathways. Compounds like this are often studied for their interactions with enzymes and receptors.
  • Phosphorylation: The phosphoryl group within this compound is involved in energy transfer processes in biological systems, mirroring the structural features of ATP, an essential energy currency of all living cells.
  • Synthetic Applications: This compound may serve as an important intermediate in the synthesis of more complex biomolecules. Its unique structure allows for various chemical modifications, paving the way for the development of novel pharmaceutical agents.

Notably, the dual role of this compound as both a phospho- and amino- derivative showcases the intricate balance within biological systems where nucleophilic substitutions are crucial for metabolic processes. As a chemistry student or scientist, examining how such compounds function within larger biological contexts can lead to significant discoveries in drug development and therapeutic interventions.

Understanding the reactivity and properties of this compound may provide insights into the mechanisms of action at the molecular level, blending synthetic organic chemistry with biochemistry in a symphony of innovative research.

Synonyms
4-amino-1-{5-o-[{[(2-aminoethoxy)(hydroxy)phosphoryl]oxy}(hydroxy)phosphoryl]pentofuranosyl}pyrimidin-2(1h)-one
DTXSID30863084