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(2-ethyl-3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinolin-5-yl) 3,4,5-trimethoxybenzoate

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Identification
Molecular formula
C21H31NO5
CAS number
.23-405-6
IUPAC name
(2-ethyl-3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinolin-5-yl) 3,4,5-trimethoxybenzoate
State
State

At room temperature, the compound is typically in a solid state, often observed as a crystalline powder.

Melting point (Celsius)
121.00
Melting point (Kelvin)
394.15
Boiling point (Celsius)
485.00
Boiling point (Kelvin)
758.15
General information
Molecular weight
381.49g/mol
Molar mass
381.4890g/mol
Density
1.2105g/cm3
Appearence

The compound is typically a colorless to pale yellow crystalline solid, though it might be found as a powder depending on its level of purification and storage conditions.

Comment on solubility

Solubility of (2-ethyl-3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinolin-5-yl) 3,4,5-trimethoxybenzoate

The solubility of the compound (2-ethyl-3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinolin-5-yl) 3,4,5-trimethoxybenzoate can be influenced by several factors related to its chemical structure. Generally, the solubility of organic compounds can be assessed based on the following aspects:

  • Polarity: The presence of multiple methoxy groups in the benzoate contributes to its overall polarity, which may enhance solubility in polar solvents.
  • Hydrophobic Interactions: The hydrocarbon chains of the isoquinoline structure may create regions that interact favorably with non-polar solvents, potentially increasing solubility in organic solvents.
  • Dissolution Conditions: The temperature and pH of the solvent can significantly affect solubility; higher temperatures often lead to increased solubility.
  • Solvent Type: Solubility behavior can vary greatly between different solvents; for example, this compound may show higher solubility in ethanol or methanol compared to water.

As a general observation, while the compound may have limited solubility in water due to its complex structure, it could demonstrate substantial solubility in organic solvents. The intricate balance of hydrophobic and hydrophilic elements within the compound indicates a potential for novel solubility properties that can be exploited in various applications.

Interesting facts

Interesting Facts About (2-ethyl-3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinolin-5-yl) 3,4,5-trimethoxybenzoate

This intriguing compound belongs to a class of organic chemicals known for their diverse applications in pharmaceuticals and chemical research. Here are some captivating insights:

  • Structural Complexity: The compound features a unique structure that includes an isoquinoline moiety, which is often associated with various biological activities, making it a subject of interest in medicinal chemistry.
  • Natural Product Inspiration: Many related structures are derived from natural products, suggesting that compounds like these could potentially be synthesized to mimic or enhance the properties of naturally occurring substances.
  • Pharmacological Potential: Compounds with similar structural features have been extensively studied for their potential in treating neurological disorders, as well as exhibiting anti-inflammatory and analgesic effects.
  • Synthesis Challenges: The synthesis of such tetracyclic structures often poses significant challenges in organic chemistry, providing students and researchers with exciting problems to solve!
  • Modern Applications: Beyond pharmaceuticals, the compound’s derivatives may find applications in material sciences, particularly in the development of novel polymers and organic electronic materials.

As we continue to explore the implications of complex organic compounds like (2-ethyl-3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinolin-5-yl) 3,4,5-trimethoxybenzoate, it is clear that understanding their properties and reactions will contribute significantly to advancements in various scientific fields.

Synonyms
NIOSH/DH9900000
DH99000000
5-Isoquinolinol, decahydro-2-ethyl-, 3,4,5-trimethoxyzenzoate, (Z)-
Benzoic acid, 3,4,5-trimethoxy-, decahydro-2-ethyl-5-isoquinolyl ester, cis-
cis-5,9,10-H-5-(3,4,5-Trimethoxybenzoyloxy)-2-ethyldecahydroisoquinoline