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Cholesteryl acetate

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Identification
Molecular formula
C29H48O2
CAS number
604-35-3
IUPAC name
[(3S,5S)-17-(1,5-dimethylhexyl)-10,13-dimethyl-6-oxo-1,2,3,4,5,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-3-yl] acetate
State
State

At room temperature, cholesteryl acetate is a solid compound. It is predominantly used in the laboratory and industrial settings in its solid form.

Melting point (Celsius)
113.00
Melting point (Kelvin)
386.15
Boiling point (Celsius)
518.30
Boiling point (Kelvin)
791.50
General information
Molecular weight
428.72g/mol
Molar mass
428.7170g/mol
Density
1.0600g/cm3
Appearence

Cholesteryl acetate is a white crystalline powder. It is often found as odorless crystals or powder, characterized by its solid state and waxy texture.

Comment on solubility

Solubility of [(3S,5S)-17-(1,5-dimethylhexyl)-10,13-dimethyl-6-oxo-1,2,3,4,5,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-3-yl] acetate

The solubility of this complex organic compound is an area of considerable interest, especially given its intricate structure. Understanding its solubility is crucial for applications in medicinal chemistry and pharmacology.

Factors Influencing Solubility

Several factors play a significant role in determining the solubility of this compound:

  • Polarity: The presence of functional groups that influence an overall dipole moment can drastically affect solubility in polar versus nonpolar solvents.
  • Molecular Weight: Larger molecular weights, as seen in this compound, tend to decrease solubility due to increased steric hindrance.
  • Hydrophobic Character: The long carbon chains present suggest a hydrophobic nature, potentially limiting solubility in aqueous environments but enhancing solubility in organic solvents.

Expected Solubility Behavior

Based on its structure, it can be anticipated that:

  • This compound may exhibit low solubility in water due to its hydrophobic features.
  • It might dissolve well in organic solvents such as ethanol, acetone, and chloroform, which can accommodate larger, nonpolar molecules.
  • pH levels of the solution might also alter its solubility dynamics, though little specific data exists on this aspect.

In conclusion, while specific solubility values remain to be established through empirical testing, it is clear that the solubility characteristics of [(3S,5S)-17-(1,5-dimethylhexyl)-10,13-dimethyl-6-oxo-1,2,3,4,5,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-3-yl] acetate would be primarily influenced by its structural features, particularly its hydrophobic nature and functional group interactions.

Interesting facts

Interesting Facts about [(3S,5S)-17-(1,5-dimethylhexyl)-10,13-dimethyl-6-oxo-1,2,3,4,5,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-3-yl] Acetate

This complex compound, often used in scientific research and applications, is intriguing due to its unique structural features and potential biological activities. Here are some engaging points:

  • Synthetic Origin: This compound is a derivative of natural steroidal frameworks which are significant in medicinal chemistry.
  • Biological Activity: Research suggests that compounds like this one may exhibit hormonal activity, interacting with androgen and estrogen receptors, which could have implications in fields like endocrinology and oncology.
  • Structural Complexity: It contains multiple chiral centers, indicating that its stereochemistry is crucial for its activity. The specific 3S and 5S configurations suggest that this compound could have selective binding properties.
  • Research Potential: The potential applications of such compounds in therapeutic areas, including cancer treatment and hormonal therapies, make them a topic of ongoing research.
  • Analytical Techniques: Characterizing this compound often requires sophisticated analytical methods such as NMR (Nuclear Magnetic Resonance) and mass spectrometry to elucidate its structure.

Overall, the intriguing nature of [(3S,5S)-17-(1,5-dimethylhexyl)-10,13-dimethyl-6-oxo-1,2,3,4,5,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-3-yl] acetate makes it a valuable subject in the pursuit of new therapeutic agents and understanding complex biological systems.

Synonyms
6-Oxocholestan-3-yl acetate
DTXSID60925184