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Codeine methylbromide

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Identification
Molecular formula
C20H25NO4
CAS number
125-25-2
IUPAC name
[8-acetoxy-11-ethyl-5,7,14-trihydroxy-6,16,18-trimethoxy-13-(methoxymethyl)-11-azahexacyclo[7.7.2.12,5.01,10.03,8.013,17]nonadecan-4-yl] benzoate
State
State

In its standard state at room temperature, codeine methylbromide is a solid.

Melting point (Celsius)
247.00
Melting point (Kelvin)
520.15
Boiling point (Celsius)
345.00
Boiling point (Kelvin)
618.15
General information
Molecular weight
390.37g/mol
Molar mass
390.3670g/mol
Density
1.3400g/cm3
Appearence

Codeine methylbromide typically appears as white or nearly white crystalline powder. It is odorless and has a bitter taste. The compound is also hygroscopic, meaning it can absorb moisture from the air.

Comment on solubility

Solubility of 8-acetoxy-11-ethyl-5,7,14-trihydroxy-6,16,18-trimethoxy-13-(methoxymethyl)-11-azahexacyclo[7.7.2.12,5.01,10.03,8.013,17]nonadecan-4-yl benzoate (C20H25NO4)

The solubility of 8-acetoxy-11-ethyl-5,7,14-trihydroxy-6,16,18-trimethoxy-13-(methoxymethyl)-11-azahexacyclo[7.7.2.12,5.01,10.03,8.013,17]nonadecan-4-yl benzoate is affected by several factors:

  • Polarity: The presence of multiple hydroxy (-OH) and methoxy (-OCH3) functional groups suggests that the compound may demonstrate a degree of polarity, which can enhance its solubility in polar solvents such as water or alcohols.
  • Hydrogen Bonding: The hydroxyl groups are likely to form hydrogen bonds, further influencing solubility. This can facilitate interactions with water molecules, enhancing solubility.
  • Solvent Interaction: In organic solvents, the compound may exhibit better solubility due to its extensive aliphatic and aromatic structures which can engage in van der Waals forces.
  • Temperature Dependence: Solubility may vary with temperature; generally, an increase in temperature can improve solubility for many organic compounds.

In summary, while the complex structure of C20H25NO4 indicates potential for solubility in both polar and non-polar solvents, it is imperative to experimentally determine the exact solubility parameters in relevant solvents due to the intricate interplay of molecular interactions. As emphasized in solubility studies, "the more complex the structure, the more complex the solubility behavior can be." Thus, practical experiments are essential to ascertain solubility in various environments.

Interesting facts

Interesting Facts about 8-acetoxy-11-ethyl-5,7,14-trihydroxy-6,16,18-trimethoxy-13-(methoxymethyl)-11-azahexacyclo[7.7.2.12,5.01,10.03,8.013,17]nonadecan-4-yl benzoate

This intriguing compound is a complex derivative known for its structural intricacies and potential applications in various fields. The multifaceted nature of its structure showcases the diversity of chemical compounds found in organic chemistry.

Key Characteristics:

  • Complex Structure: The compound features a hexacyclic framework which indicates that it may possess unique physical properties and reactivity.
  • Substituent Diversity: With multiple functional groups, including methoxy and hydroxyl groups, this compound is likely to participate in a variety of chemical reactions.
  • Potential Applications: The presence of both the benzoate moiety and the azahexacyclo structure suggests feasibility for use in pharmaceuticals and biotechnology.

Chemical Behavior:

Due to its intricate structure, the compound displays:

  • Hydrophilicity and Hydrophobicity: The balance of polar and non-polar groups can influence solubility in biological systems.
  • Reactivity: The hydroxyl and methoxy groups create sites for potential reactivity, which could be harnessed in synthetic chemistry.

A fascinating aspect of this compound lies in its potential as a lead structure in drug discovery, especially considering the significant role cycloalkanes and modified phenolic compounds play in medicinal chemistry. As researchers delve deeper, new applications may arise, contributing to advancements in therapeutic solutions.

In summary, this compound is not just a chemical entity; it embodies the blend of creativity and complexity found in the world of organic chemistry, offering a promising avenue for exploration within the scientific community.

Synonyms
aconitine
Aconitin cristallisat
Aconitinum
302-27-2
[8-acetyloxy-11-ethyl-5,7,14-trihydroxy-6,16,18-trimethoxy-13-(methoxymethyl)-11-azahexacyclo[7.7.2.12,5.01,10.03,8.013,17]nonadecan-4-yl] benzoate
SCHEMBL15681737
CHEBI:181261
XFSBVAOIAHNAPC-UHFFFAOYSA-N
2H-12,3,6a-Ethanylylidene-7,9-methanonaphth[2,3-b]azocine, aconitane-3,8,13,14,15-pentol deriv.
8-(Acetyloxy)-20-ethyl-3,13,15-trihydroxy-1,6,16-trimethoxy-4-(methoxymethyl)aconitan-14-yl benzoate #
Aconitane-3,8,13,14,15-pentol, 20-ethyl-1,6,16-trimethoxy-4-(methoxymethyl)-, 8-acetate 14-benzoate, (1.alpha.,3.alpha.,6.alpha.,14.alpha.,15.alpha.,16.beta.)-