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2,4,6-tris(aziridin-1-yl)-1,3,5-triazine

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Identification
Molecular formula
C12H18N6O3
CAS number
101-80-4
IUPAC name
aziridin-1-yl-[3,5-bis(aziridine-1-carbonyl)phenyl]methanone
State
State

At room temperature, 2,4,6-tris(aziridin-1-yl)-1,3,5-triazine is typically solid. It is stable under normal conditions, but care should be taken to avoid exposure to moisture and light, which can cause degradation.

Melting point (Celsius)
124.00
Melting point (Kelvin)
397.00
Boiling point (Celsius)
204.00
Boiling point (Kelvin)
477.00
General information
Molecular weight
219.28g/mol
Molar mass
219.2800g/mol
Density
1.4000g/cm3
Appearence

2,4,6-Tris(aziridin-1-yl)-1,3,5-triazine, commonly known as triazine trione, appears as a colorless or pale yellow crystalline solid. It may have a waxy texture, and its clarity and form can change depending on the conditions of crystallization and purity.

Comment on solubility

Solubility of Aziridin-1-yl-[3,5-bis(aziridine-1-carbonyl)phenyl]methanone

The solubility of aziridin-1-yl-[3,5-bis(aziridine-1-carbonyl)phenyl]methanone presents an intriguing aspect of its chemical behavior. This compound, characterized by its multiple aziridine units, tends to exhibit varying solubility based on different factors. Here are some key points to consider:

  • Polarity: The presence of multiple aziridine rings can contribute to the molecule's overall polarity. Polar compounds typically have better solubility in polar solvents such as water or alcohols.
  • Hydrogen Bonding: With numerous carbonyl (C=O) functional groups, hydrogen bonding interactions may enhance the solubility in protic solvents.
  • Solvent Compatibility: It is important to test solubility in various solvents to ascertain the best medium for dissolution. Common solvents include:
    • Water
    • Ethanol
    • DMSO (Dimethyl sulfoxide)
  • Temperature Influence: As with many organic compounds, increased temperature can lead to greater solubility. A systematic investigation across temperature ranges can reveal more about its solubility profile.
  • Crystal Structure: The crystalline arrangement of the compound can also play a role in its solubility, often requiring specific conditions to fully engage with solvent molecules.

In conclusion, while aziridin-1-yl-[3,5-bis(aziridine-1-carbonyl)phenyl]methanone’s solubility is influenced by its structural components and the solvent environment, empirical testing remains essential for exact solubility determinations. As stated in the chemical literature, "Understanding solubility is crucial for practical applications in synthesis and formulation." This highlights the importance of rigorous exploration of solubility characteristics to fully harness the compound's potential in various chemical contexts.

Interesting facts

Exploring Aziridin-1-yl-[3,5-bis(aziridine-1-carbonyl)phenyl]methanone

Aziridin-1-yl-[3,5-bis(aziridine-1-carbonyl)phenyl]methanone is a fascinating compound that showcases the intriguing world of aziridines, which are three-membered nitrogen-containing heterocycles. This compound holds significant interest due to its structural complexity and potential applications in various fields. Here are some compelling facts:

Key Features

  • Pharmacological Potential: Compounds containing aziridine groups are often explored for their biological activities, particularly in drug design. They may exhibit anticancer or antimicrobial properties, making them intriguing candidates for pharmaceutical research.
  • Synthetic Versatility: The presence of multiple functional groups allows for various synthetic modifications, providing chemists with numerous avenues for further study and application.
  • Cyclic Structure: The unique three-membered ring structure imparts strain, which can influence reactivity and interactions with biological macromolecules, offering interesting pathways for research in medicinal chemistry.

Applications & Relevance

In the realm of organic synthesis, aziridines are often employed as intermediates for a range of chemical transformations, leading to the development of valuable chemical entities. The compound's structure suggests potential applications in:

  • Drug development and medicinal chemistry
  • Agrochemicals
  • Material science, especially in the development of polymers and coatings

Moreover, this compound provides a rich platform for research into chirality and stereochemistry due to the asymmetry in its structure. Researchers frequently explore how such properties can be leveraged to enhance biological activity.

In Summary

Overall, aziridin-1-yl-[3,5-bis(aziridine-1-carbonyl)phenyl]methanone embodies the complexities and vast potential of aziridine-derived compounds. Its unique structural characteristics not only make it a subject of interest for chemists but also highlight its possible implications in future technological developments and therapeutic applications.

Synonyms
16044-74-9
s-Phenenyltris(carbonylaziridine)
AZIRIDINE, (s-PHENENYLTRICARBONYL)TRIS-
YZ7OZW5CTX
1,1',1''-(s-Phenenyltricarbonyl)trisaziridine
Aziridine, 1,1',1''-(s-phenenyltricarbonyl)tris-
NSC-40559
aziridin-1-yl-[3,5-bis(aziridine-1-carbonyl)phenyl]methanone
NSC 40559
BRN 1326710
NSC40559
UNII-YZ7OZW5CTX
DTXSID30166885
1,1''-(s-Phenenyltricarbonyl)trisaziridine
Aziridine,1',1''-(s-phenenyltricarbonyl)tris-
WLN: T3NTJ AVR CV- AT3NTJ& EV- AT3NTJ
AZIRIDINE, 1,1',1''-(S-PHENYLTRICARBONYL)TRIS-