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Epoxyoxetane

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Identification
Molecular formula
C22H30O8
CAS number
93979-17-4
IUPAC name
[(4S,10R,11S)-11-acetoxy-2-(acetoxymethyl)-10-hydroxy-1,5-dimethyl-spiro[8-oxatricyclo[7.2.1.02,7]dodec-5-ene-12,2'-oxirane]-4-yl] 3-methylbutanoate
State
State

At room temperature, this compound exists as a solid. Due to its crystalline nature, it maintains a stable formation until reaching its melting point.

Melting point (Celsius)
85.00
Melting point (Kelvin)
358.15
Boiling point (Celsius)
298.00
Boiling point (Kelvin)
571.15
General information
Molecular weight
417.48g/mol
Molar mass
417.4770g/mol
Density
1.2000g/cm3
Appearence

This compound typically appears as a white crystalline solid. Its crystalline structure can vary slightly depending on temperature and purity, leading to different forms, usually white or off-white.

Comment on solubility

Solubility Properties of [(4S,10R,11S)-11-acetoxy-2-(acetoxymethyl)-10-hydroxy-1,5-dimethyl-spiro[8-oxatricyclo[7.2.1.02,7]dodec-5-ene-12,2'-oxirane]-4-yl] 3-methylbutanoate

The solubility of the compound [(4S,10R,11S)-11-acetoxy-2-(acetoxymethyl)-10-hydroxy-1,5-dimethyl-spiro[8-oxatricyclo[7.2.1.02,7]dodec-5-ene-12,2'-oxirane]-4-yl] 3-methylbutanoate can be affected by several factors, making its behavior in various solvents noteworthy:

  • Polarity: The presence of multiple functional groups, such as acetoxy and hydroxy, suggests that the compound may exhibit varying degrees of polarity, potentially enhancing solubility in polar solvents like water or alcohols.
  • Hydrogen Bonding: The hydroxyl groups can form hydrogen bonds, which generally increases solubility in polar media.
  • Hydrophobic Regions: The spirocyclic structure may lead to hydrophobic characteristics, affecting the solubility in non-polar solvents.
  • Temperature: Solubility can be temperature-dependent; thus, increasing the temperature may improve the solubility of this compound in certain solvents.

In general, while one might predict that [(4S,10R,11S)-11-acetoxy-2-(acetoxymethyl)-10-hydroxy-1,5-dimethyl-spiro[8-oxatricyclo[7.2.1.02,7]dodec-5-ene-12,2'-oxirane]-4-yl] 3-methylbutanoate could exhibit moderate solubility in a range of solvents, empirical testing is essential to determine actual solubility profiles in specific conditions.

Interesting facts

Interesting Facts about [(4S,10R,11S)-11-acetoxy-2-(acetoxymethyl)-10-hydroxy-1,5-dimethyl-spiro[8-oxatricyclo[7.2.1.02,7]dodec-5-ene-12,2'-oxirane]-4-yl] 3-methylbutanoate

This compound, with its complex structure, offers a fascinating glimpse into the realm of organic chemistry and the intricacies of molecular architecture. Here are some engaging details:

  • Stereochemistry: The compound has specific stereochemical configurations indicated by the (4S,10R,11S) designation. This highlights the importance of stereoisomers in determining a compound's properties and how it interacts biologically.
  • Natural Product Derivative: It is a derivative from a natural product, typically leading to interesting biological activities. Compounds like this one play a critical role in pharmaceuticals and can inspire new drug designs.
  • Functional Groups: The presence of acetoxy groups suggests potential reactivity in synthetic transformations, offering pathways for functionalization or modification to enhance its utility in various applications.
  • Applications: Compounds of this type could be used in medicinal chemistry due to their potential antibacterial or antiviral properties, making them valuable in drug discovery.
  • Complexity in Synthesis: The intricate structure of this compound presents challenges and opportunities in the synthesis process, requiring advanced techniques and methodologies in organic synthesis.

As a chemistry student, one might reflect on the significance of such compounds in advancing the field of chemistry: "The beauty of chemistry lies within its complexity; every compound tells a story waiting to be unraveled."

Exploring compounds like [(4S,10R,11S)-11-acetoxy-2-(acetoxymethyl)-10-hydroxy-1,5-dimethyl-spiro[8-oxatricyclo[7.2.1.02,7]dodec-5-ene-12,2'-oxirane]-4-yl] 3-methylbutanoate not only enriches our knowledge but also inspires innovation in synthetic and medicinal chemistry.

Synonyms
Insariotoxin
SCHEMBL29526821
Q421570