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Torcetrapib

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Identification
Molecular formula
C39H50O10S
CAS number
262352-17-0
IUPAC name
[4-hydroxy-3-[[1-hydroxy-5-[4-(6-hydroxy-2,2,5a,7-tetramethyl-4,5,7,8,9,9a-hexahydro-3H-benzo[b]oxepin-6-yl)butyl]-3,3,5-trimethyl-2-bicyclo[2.2.2]octanyl]methyl]phenyl] hydrogen sulfate
State
State

Torcetrapib is typically encountered as a solid at room temperature, due to its high melting point. It remains stable and maintains its form unless subjected to conditions over its boiling point or mixed with solvents leading to dissolution.

Melting point (Celsius)
125.00
Melting point (Kelvin)
398.15
Boiling point (Celsius)
513.15
Boiling point (Kelvin)
786.30
General information
Molecular weight
664.92g/mol
Molar mass
664.9220g/mol
Density
1.3165g/cm3
Appearence

Torcetrapib is generally isolated as a white, crystalline powder. Its appearance may vary slightly depending on the purity and specific polymorphic form that is isolated during synthesis, but it is generally not visible as a colored compound and lacks any significant odor.

Comment on solubility

Solubility of 4-hydroxy-3-[[1-hydroxy-5-[4-(6-hydroxy-2,2,5a,7-tetramethyl-4,5,7,8,9,9a-hexahydro-3H-benzo[b]oxepin-6-yl)butyl]-3,3,5-trimethyl-2-bicyclo[2.2.2]octanyl]methyl]phenyl] hydrogen sulfate (C39H50O10S)

The solubility of 4-hydroxy-3-[[1-hydroxy-5-[4-(6-hydroxy-2,2,5a,7-tetramethyl-4,5,7,8,9,9a-hexahydro-3H-benzo[b]oxepin-6-yl)butyl]-3,3,5-trimethyl-2-bicyclo[2.2.2]octanyl]methyl]phenyl] hydrogen sulfate is influenced by several key factors:

  • Water Solubility: This compound is likely to exhibit limited solubility in water due to its large molecular structure and the presence of hydrophobic components.
  • Solvent Interactions: Its solubility can be markedly improved in organic solvents, where the non-polar regions can interact favorably.
  • pH Dependence: As a hydrogen sulfate, the solubility may also depend on the pH of the solution. Adjusting the pH could potentially enhance dissolution.
  • Temperature Effects: Increased temperature often enhances the solubility of organic compounds due to greater molecular motion and energy.

To summarize, while some aspects of solubility in aqueous environments may seem restrictive for this complex structure, exploring various solvents and conditions will reveal its potential for effective dissolution. As the old saying goes, "like dissolves like", making it pivotal to select appropriate solvents for optimal solubility.

Interesting facts

Interesting Facts about 4-Hydroxy-3-[[1-Hydroxy-5-[4-(6-Hydroxy-2,2,5a,7-tetramethyl-4,5,7,8,9,9a-Hexahydro-3H-Benzo[b]oxepin-6-yl)butyl]-3,3,5-Trimethyl-2-Bicyclo[2.2.2]Octanyl]Methyl]Phenyl Hydrogen Sulfate

The compound 4-hydroxy-3-[[1-hydroxy-5-[4-(6-hydroxy-2,2,5a,7-tetramethyl-4,5,7,8,9,9a-hexahydro-3H-benzo[b]oxepin-6-yl)butyl]-3,3,5-trimethyl-2-bicyclo[2.2.2]octanyl]methyl]phenyl] hydrogen sulfate is a fascinating example of a complex organic compound. Its unique structure holds significant promise in various fields, including pharmaceuticals and material science. Here are some interesting facts about this compound:

  • Complex Structure: The compound features multiple functional groups, which can impart unique properties and reactivity. This complexity may enhance its potential applications in developing innovative materials.
  • Pharmacological Potential: Compounds of this nature typically exhibit various biological activities, making them valuable for drug development. Their intricate arrangements often lead to specific interactions with biological targets.
  • Synthetic Challenge: The synthesis of such a molecule may present a challenge for chemists due to potential steric hindrance and the need for precise reaction conditions. This can foster creativity and innovation in synthetic methodologies.
  • Environmental Considerations: The presence of hydrogen sulfate groups can provide insights into the environmental impact and degradation pathways of the compound. Understanding these factors is crucial for assessing its safety and application.
  • Multifunctional Applications: Due to its structural diversity, this compound could potentially serve in multifunctional capacities, including catalysts, sensors, and additives in materials science.

As with many complex organic molecules, the study and understanding of this compound not only enhance our knowledge of chemistry but also open up possibilities for practical and impactful applications in the future. The journey of exploring such compounds is an exciting aspect of a chemist's life!