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Calcitriol

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Identification
Molecular formula
C27H44O3
CAS number
32222-06-3
IUPAC name
6-[4-[2-(5-hydroxy-2-methylene-cyclohexylidene)ethylidene]-7a-methyl-2,3,3a,5,6,7-hexahydro-1H-inden-1-yl]-2-methyl-heptane-2,3-diol
State
State
Calcitriol is typically a solid at room temperature, existing as a crystalline powder. It is important in biochemical contexts and serves as a vital component in the body's regulation of calcium levels.
Melting point (Celsius)
113.00
Melting point (Kelvin)
386.00
Boiling point (Celsius)
628.00
Boiling point (Kelvin)
901.00
General information
Molecular weight
416.65g/mol
Molar mass
416.6480g/mol
Density
0.9295g/cm3
Appearence

Calcitriol is a white, crystalline compound. It is known for its presence as the active form of vitamin D3 and is not associated with any color or odor.

Comment on solubility

Solubility of 6-[4-[2-(5-hydroxy-2-methylene-cyclohexylidene)ethylidene]-7a-methyl-2,3,3a,5,6,7-hexahydro-1H-inden-1-yl]-2-methyl-heptane-2,3-diol

The solubility of 6-[4-[2-(5-hydroxy-2-methylene-cyclohexylidene)ethylidene]-7a-methyl-2,3,3a,5,6,7-hexahydro-1H-inden-1-yl]-2-methyl-heptane-2,3-diol, with the chemical formula C27H44O3, can be characterized as follows:

  • Solvent Dependency: The solubility of this compound is largely influenced by the nature of the solvent. Polar solvents tend to dissolve polar compounds more effectively, while nonpolar solvents are better for nonpolar compounds.
  • Temperature Influence: Temperature plays a crucial role in solubility; generally, an increase in temperature can enhance the solubility of solid compounds.
  • Hydroxyl Group Contribution: The presence of hydroxyl (–OH) groups in the chemical structure can impart some degree of polarity, potentially allowing for moderate solubility in polar solvents such as alcohols or acids.
  • Molecular Structure: Due to its large and complex molecular structure, the overall solubility in water is likely to be low, as larger organic compounds typically have challenges dissolving in aqueous environments.

In conclusion, the solubility of this compound can be considered limited in water but may exhibit variable solubility in organic solvents depending on their polarity and temperature, making it essential to choose the appropriate solvent for practical applications.

Interesting facts

Interesting Facts about 6-[4-[2-(5-hydroxy-2-methylene-cyclohexylidene)ethylidene]-7a-methyl-2,3,3a,5,6,7-hexahydro-1H-inden-1-yl]-2-methyl-heptane-2,3-diol

This compound is a fascinating example of complex organic chemistry, showcasing the diversity of molecular architecture that can be achieved by the manipulation of simple building blocks. Here are some intriguing aspects about it:

  • Structural Complexity: The structure includes multiple functional groups and stereocenters, which creates unique 3D arrangements in the molecule. This complexity is essential for its potential bioactivity.
  • Natural Compounds: It could relate to naturally occurring substances often found in plants, showcasing the relationship between these compounds and their medicinal properties.
  • Potential Applications: Compounds like this often exhibit interesting properties that may lead to applications in pharmaceuticals or agrochemicals, pointing towards their significance in medicinal chemistry.
  • Research Opportunities: The intricate stereochemistry presents an opportunity for chemists to investigate various synthetic pathways and the reactivity of the functional groups involved.
  • Interdisciplinary Relevance: Its study combines aspects of organic chemistry, medicinal chemistry, and even environmental science, illustrating its potential impact across multiple scientific fields.

In summary, 6-[4-[2-(5-hydroxy-2-methylene-cyclohexylidene)ethylidene]-7a-methyl-2,3,3a,5,6,7-hexahydro-1H-inden-1-yl]-2-methyl-heptane-2,3-diol represents not just a compound of interest, but also a gateway into the world of complex organic structures with significant implications for health and sustainability.

Synonyms
55700-58-8
24,25-Dihydroxycholecalciferol
DTXSID40860685
(3S,6R)-6-[(1R,3aR,4E,7aS)-4-[(2Z)-2-[(5R)-5-hydroxy-2-methylidene-cyc lohexylidene]ethylidene]-7a-methyl-2,3,3a,5,6,7-hexahydro-1H-inden-1-y l]-2-methyl-heptane-2,3-diol
9,10-Secocholesta-5,7,10-triene-3,24,25-triol