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Isoxacalone

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Identification
Molecular formula
C12H11NO2
CAS number
115894-73-8
IUPAC name
12-azatricyclo[4.4.3.01,6]trideca-3,8-diene-11,13-dione
State
State

Isoxacalone is in a solid state at room temperature. It is not typically volatile unless subjected to extreme conditions.

Melting point (Celsius)
174.00
Melting point (Kelvin)
447.15
Boiling point (Celsius)
345.00
Boiling point (Kelvin)
618.15
General information
Molecular weight
215.23g/mol
Molar mass
215.2300g/mol
Density
1.3703g/cm3
Appearence

Isoxacalone typically appears as a crystalline white solid. It possesses a specific crystal structure that contributes to its distinct form.

Comment on solubility

Solubility of 12-azatricyclo[4.4.3.01,6]trideca-3,8-diene-11,13-dione

The solubility of 12-azatricyclo[4.4.3.01,6]trideca-3,8-diene-11,13-dione is influenced by its unique structural features and functional groups. Here are some key points to consider:

  • Polar vs Nonpolar: The solubility of this compound may vary significantly in polar and nonpolar solvents due to the presence of dicarbonyl functional groups. Generally, compounds containing such groups tend to be more soluble in polar solvents.
  • Hydrogen Bonding: The ability to form hydrogen bonds can enhance solubility in water. Depending on its conformation and the availability of hydrogen-bonding sites, 12-azatricyclo[4.4.3.01,6]trideca-3,8-diene-11,13-dione could exhibit differing solubility in aqueous solutions.
  • Temperature Effects: Solubility can also be temperature-dependent. As temperature increases, solubility often improves for organic compounds, making it essential to consider the specific temperature conditions during experimentation.

In conclusion, while 12-azatricyclo[4.4.3.01,6]trideca-3,8-diene-11,13-dione may have unique solubility characteristics due to its complex structure, precise solubility data would ideally come from experimental observations. Understanding these solubility traits is crucial for applications in chemical synthesis, formulation, and research.

Interesting facts

Interesting Facts about 12-Azatricyclo[4.4.3.01,6]trideca-3,8-diene-11,13-dione

12-Azatricyclo[4.4.3.01,6]trideca-3,8-diene-11,13-dione is a fascinating compound that offers a unique glimpse into the world of organic chemistry. Here are some notable aspects of this chemical:

  • Structural Complexity: This compound features a distinctive tricyclic core structure, which contributes to its intriguing chemical properties. The presence of an azatriene gives rise to interesting electronic effects affecting reactivity.
  • Biological Relevance: Many compounds that contain similar structural frameworks have been studied for their potential biological activities, ranging from pharmacological effects to naturally occurring metabolites in various organisms.
  • Reactivity Patterns: The presence of dione functional groups within the molecule suggests it may participate in a variety of *nucleophilic and electrophilic reactions*, making it a candidate for further synthetic exploration.
  • Synthesis Innovations: Creating this compound often involves sophisticated synthetic methodologies, including multi-step reactions that demonstrate the ingenuity required in organic synthesis today.
  • Role in Research: **12-Azatricyclo[4.4.3.01,6]trideca-3,8-diene-11,13-dione** serves as a valuable research tool for chemists investigating the behavior of heterocycles and dione systems.

In summary, the compound's structural features and the versatility of its dione groups make it a noteworthy subject of study. As chemists continue to unveil its potential applications, it serves as a reminder of the complexity and beauty inherent in organic compounds.

Synonyms
BRN 1531498
1,4,5,8-Tetrahydro-4a,8a-naphthalenedicarboximide
16609-40-8
DTXSID20168075
1,4,5,8-Tetrahydro-4a,8a-(methaniminomethano)naphhlalene-9,11-dione
4a,8a-(Methaniminomethano)naphthalene-9,11-dione, 1,4,5,8-tetrahydro-
4a,8a-NAPHTHALENEDICARBOXIMIDE, 1,4,5,8-TETRAHYDRO-
4a,8a-(Methaniminomethano)naphthalene-9,11-dione, 1,4,5,8-tetrahydro-(9CI)
DTXCID8090566
4a,8a-(Methaniminomethano)naphthalene-9,11-dione, 1,4,5,8-tetrahydro- (9CI)