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Estradiol diheptanoate

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Identification
Molecular formula
C39H58O4
CAS number
2363-58-8
IUPAC name
(3-heptanoyloxy-13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-17-yl) heptanoate
State
State

At room temperature, estradiol diheptanoate is in a solid state. It is often used in a crystalline form for laboratory and pharmaceutical applications.

Melting point (Celsius)
133.00
Melting point (Kelvin)
406.15
Boiling point (Celsius)
518.30
Boiling point (Kelvin)
791.50
General information
Molecular weight
552.80g/mol
Molar mass
552.7990g/mol
Density
1.0600g/cm3
Appearence

Estradiol diheptanoate is typically seen as a white or off-white crystalline powder. Its appearance is consistent with other steroidal esters, with crystals forming as fine, powdery particles.

Comment on solubility

Solubility of (3-heptanoyloxy-13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-17-yl) heptanoate

The solubility of (3-heptanoyloxy-13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-17-yl) heptanoate is primarily influenced by its complex molecular structure and functional groups. Understanding its solubility is crucial for various applications, including pharmacology and organic synthesis. Here are some key points to consider:

  • Polarity: This compound exhibits characteristics of both non-polar and polar regions due to the presence of the heptanoyloxy group. As a general rule, "like dissolves like," indicating that it may be soluble in non-polar solvents such as hexane.
  • Hydrophobicity: The hydrocarbon framework contributes significantly to its hydrophobic nature, which can limit solubility in water. Therefore, it may be poorly soluble in aqueous solutions.
  • Temperature Effects: Solubility can vary with temperature; increasing the temperature often enhances solubility for organic compounds. Thus, evaluating solubility under different thermal conditions is advisable.
  • Interactions with Solvents: The potential for hydrogen bonding with polar solvents may influence solubility. However, the extensive carbon chain likely reduces this potential.

In conclusion, the solubility of this compound is a complex interplay of its structural components and the solvents in question. Further experimental studies are required to determine exact solubility parameters, but this foundational understanding provides a basis for both theoretical exploration and practical applications.

Interesting facts

Interesting Facts about (3-heptanoyloxy-13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-17-yl) heptanoate

This compound is a fascinating example of a complex organic molecule that may serve various purposes in chemical research and potential applications in medicine. The intricate structure contains multiple functional groups, which can influence its chemical reactivity and interactions with biological systems.

Structural Significance

  • Cyclic Nature: The presence of a cyclopenta[a]phenanthrene framework hints at the potential for unique physical and biological properties.
  • Oxy Functional Group: The heptanoyloxy group suggests opportunities for esterification reactions, enhancing solubility in organic solvents.
  • Methyl Substitution: The methyl group at the 13th position could affect the molecular conformation and stability of the compound.

Potential Applications

This compound could be of interest in various fields:

  • Pharmaceuticals: Its structure can potentially serve as a scaffold for drug development, particularly in hormonal or anti-cancer therapies.
  • Materials Science: The unique properties of cyclopenta[a]phenanthrenes may find applications in organic electronics or photovoltaic devices.
  • Biochemistry: Investigating its interactions with biomolecules can shed light on metabolic processes or signal transmission pathways.

Research and Identity

A deeper exploration of this compound might reveal its role in:

  • In vivo and in vitro studies to illustrate its biological effects.
  • Synthetic pathways that highlight its chemical synthesis—shedding light on innovative laboratory techniques.
  • Toxicology reports to ensure safe usage in potential applications.

In summary, the compound (3-heptanoyloxy-13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-17-yl) heptanoate represents a blend of chemical complexity and biological potential. The ongoing study of its applications will likely open new avenues in both research and industry!

Synonyms
DTXSID30864112
Estra-1(10),2,4-triene-3,17-diyl diheptanoate