Difluorocortisol | Solubility of Things

Identification

Molecular formula

C₂₄H₃₀F₃O₄

CAS number

94636-69-4

IUPAC name

(4R,8S,12R,19S)-12,19-difluoro-8-(2-fluoroacetyl)-11-hydroxy-6,6,9,13-tetramethyl-5,7-dioxapentacyclo[10.8.0.02,9.04,8.013,18]icosa-14,17-dien-16-one

State

At room temperature, difluorocortisol is a solid.

Melting point (Celsius)

222.00

Melting point (Kelvin)

495.15

Boiling point (Celsius)

546.00

Boiling point (Kelvin)

819.15

General information

Molecular weight

442.49g/mol

Molar mass

442.4720g/mol

Density

1.4500g/cm³

Appearence

This compound appears as a white to off-white crystalline powder.

Comment on solubility

Solubility of (4R,8S,12R,19S)-12,19-difluoro-8-(2-fluoroacetyl)-11-hydroxy-6,6,9,13-tetramethyl-5,7-dioxapentacyclo[10.8.0.02,9.04,8.013,18]icosa-14,17-dien-16-one

The solubility of complex compounds like (4R,8S,12R,19S)-12,19-difluoro-8-(2-fluoroacetyl)-11-hydroxy-6,6,9,13-tetramethyl-5,7-dioxapentacyclo[10.8.0.02,9.04,8.013,18]icosa-14,17-dien-16-one can be influenced by several factors, which can include:

Polarity: The presence of polar functional groups often enhances solubility in polar solvents, such as water.
Molecular Size: Larger molecules tend to have lower solubility due to increased steric hindrance and reduced surface area for solvation.
Hydrogen Bonding: Compounds capable of forming hydrogen bonds are usually more soluble in polar solvents.
Temperature: Generally, solubility increases with temperature for solids. For gases, solubility typically decreases.
pH Levels: Altering pH can affect ionization, thus impacting solubility, especially for weak acids or bases.

For this specific compound, its complex structure may lead to varied solubility patterns. Based on its multiple functional groups, it may exhibit:

Good solubility in organic solvents, such as ethanol or dimethyl sulfoxide (DMSO).
Limited solubility in water, potentially indicating a preference for non-polar or less polar environments.

In conclusion, while more detailed empirical data would provide better context, understanding the general principles affecting solubility allows us to make educated predictions about (4R,8S,12R,19S)-12,19-difluoro-8-(2-fluoroacetyl)-11-hydroxy-6,6,9,13-tetramethyl-5,7-dioxapentacyclo[10.8.0.02,9.04,8.013,18]icosa-14,17-dien-16-one.

Interesting facts

Interesting Facts about (4R,8S,12R,19S)-12,19-difluoro-8-(2-fluoroacetyl)-11-hydroxy-6,6,9,13-tetramethyl-5,7-dioxapentacyclo[10.8.0.02,9.04,8.013,18]icosa-14,17-dien-16-one

This complex organic compound deserves attention due to its intriguing structure and potential applications. Here are some significant highlights:

Stereochemical Variety: The compound contains multiple stereocenters, which contribute to its unique three-dimensional shape. This complexity makes it a subject of interest in stereochemistry and medicinal chemistry.
Fluorine Substituents: With two fluorine atoms in its structure, this compound showcases the significance of halogen chemistry. Fluorinated compounds often exhibit enhanced biological activity and stability.
Potential Biological Applications: The presence of functional groups such as hydroxy and fluoroacetyl positions this compound as a candidate for pharmaceutical research. The structure may hold promise in the development of new drugs or therapeutic agents.
Natural Product Inspiration: The complex bicyclic framework may mimic natural products, which often exhibit intricate structures and diverse biological activities. Many drug discoveries are inspired by the architecture of such natural compounds.
Dioxapentacyclo Skeleton: This particular arrangement of rings (pentacyclic) is rare and can impact the compound's physical and chemical properties significantly. Understanding these properties is essential for chemists working in materials science or drug design.

The exploration of compounds like this one illustrates the beauty and complexity of organic chemistry. The interplay of structure and function continues to inspire researchers in their quest for novel applications.