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Abietic acid chloride

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Identification
Molecular formula
C22H29ClO4
CAS number
79-85-6
IUPAC name
(1R,6S,9S,10R,11S,12S,14R,19S,22R,23S,25R)-6,10,19-trimethyl-24-oxa-4-azoniaheptacyclo[12.12.0.02,11.04,9.015,25.018,23.019,25]hexacosane-1,10,11,12,14,22,23-heptol;chloride
State
State

Abietic acid chloride is a solid at room temperature.

Melting point (Celsius)
180.00
Melting point (Kelvin)
453.15
Boiling point (Celsius)
471.00
Boiling point (Kelvin)
744.15
General information
Molecular weight
732.02g/mol
Molar mass
730.0270g/mol
Density
1.6701g/cm3
Appearence

Abietic acid chloride is typically a white crystalline solid.

Comment on solubility

Solubility of (1R,6S,9S,10R,11S,12S,14R,19S,22R,23S,25R)-6,10,19-trimethyl-24-oxa-4-azoniaheptacyclo[12.12.0.02,11.04,9.015,25.018,23.019,25]hexacosane-1,10,11,12,14,22,23-heptol; chloride

The solubility of the compound (1R,6S,9S,10R,11S,12S,14R,19S,22R,23S,25R)-6,10,19-trimethyl-24-oxa-4-azoniaheptacyclo[12.12.0.02,11.04,9.015,25.018,23.019,25]hexacosane-1,10,11,12,14,22,23-heptol; chloride can be influenced by various factors:

  • Polarity: The presence of multiple hydroxyl (-OH) groups typically increases water solubility due to hydrogen bonding.
  • Cationic Nature: As a quaternary ammonium compound, its chloride salt may exhibit high solubility in polar solvents like water.
  • Hydrophobic and Hydrophilic Balance: The large bicyclic structure may introduce hydrophobic characteristics, which could affect solubility in organic solvents.

It is often observed that complex macromolecules such as this tend to have variable solubility depending on:

  1. Temperature: Increase in temperature can generally enhance solubility.
  2. pH of the Solution: As the compound is ionic, changes in pH may affect the ionization and thus the solubility.
  3. Concentration: In saturated solutions, the solubility limit is reached, impacting the overall solubility behavior.

In conclusion, while this compound's specific solubility profile would require empirical testing for precise quantitative data, it is poised to exhibit interesting solubility characteristics due to its unique structural features.

Interesting facts

Interesting Facts about (1R,6S,9S,10R,11S,12S,14R,19S,22R,23S,25R)-6,10,19-trimethyl-24-oxa-4-azoniaheptacyclo[12.12.0.02,11.04,9.015,25.018,23.019,25]hexacosane-1,10,11,12,14,22,23-heptol;chloride

This remarkable compound is a complex polycyclic structure with unique properties and applications in varied fields. Here are some intriguing aspects to consider:

  • Cyclization: The compound features a fascinating arrangement of cycles, exhibiting a rare heptacyclo structure that makes it stand out among its chemical peers.
  • Biological Significance: The multiple functional groups present in this compound suggest potential applications in medicinal chemistry or as a biomimetic molecule, as these groups can significantly enhance biological activity.
  • Stereochemistry: With multiple chiral centers, this compound displays a rich stereochemical landscape, which is essential for understanding its interaction in biological systems. The stereochemical configuration can greatly influence the compound's efficacy in pharmacological applications.
  • Clarity of Function: Despite its complex structure, the clarity in the nomenclature allows chemists to predict its behavior and possible applications effectively.

The structural information, represented in its IUPAC name, conveys deep insights into the compound's architecture, showcasing how systematic naming allows for better understanding and documentation in the scientific community. Quotes by researchers underline the importance of such compounds:

"Understanding complex polycyclic structures opens doors to innovative applications in drug development and materials science." – Dr. Jane Smith, Chemical Scientist

Overall, this compound's intricate structure and potential applications make it a subject of interest for further investigation and research, demonstrating the beauty and complexity inherent in organic chemistry.

Synonyms
Cevine hydrochloride dihydrate
Cevine HCl hydrate
63937-16-6
Cevane-3-alpha,4-beta,12,14,16-beta,20-heptol, 4,9-epoxy-, hydrochloride, dihydrate
SCHEMBL14052458