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Tocopherol nicotinate

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Identification
Molecular formula
C38H59NO3
CAS number
53161-03-4
IUPAC name
[2,5,7,8-tetramethyl-2-(4,8,12-trimethyltridecyl)chroman-6-yl] pyridine-3-carboxylate
State
State

Tocopherol nicotinate is typically a liquid at room temperature, but it may solidify upon cooling depending on the exact formulation and temperature. It is soluble in fats and oils, but insoluble in water.

Melting point (Celsius)
40.00
Melting point (Kelvin)
313.15
Boiling point (Celsius)
476.00
Boiling point (Kelvin)
749.15
General information
Molecular weight
591.89g/mol
Molar mass
591.9470g/mol
Density
1.0200g/cm3
Appearence

Tocopherol nicotinate typically appears as a pale yellow to yellow viscous liquid. It is commonly used in various cosmetic formulations for its antioxidant properties.

Comment on solubility

Solubility of [2,5,7,8-tetramethyl-2-(4,8,12-trimethyltridecyl)chroman-6-yl] pyridine-3-carboxylate

The compound with the formula C38H59NO3, known as [2,5,7,8-tetramethyl-2-(4,8,12-trimethyltridecyl)chroman-6-yl] pyridine-3-carboxylate, exhibits interesting solubility characteristics due to its unique chemical structure. Understanding the solubility behavior of this compound is crucial for applications in various fields, including pharmaceuticals and materials science.

Key Points on Solubility:

  • Polarity: The presence of polar functional groups such as the pyridine and carboxylate contributes to its overall solubility profile.
  • Solvent Dependence: It is expected to be more soluble in organic solvents like ethanol and acetone than in polar solvents such as water.
  • Hydrophobic Interactions: Given the long hydrocarbon chain in its structure, the compound is likely to exhibit significant hydrophobic characteristics, affecting its interaction with different solvents.
  • Temperature Effects: An increase in temperature might enhance solubility for this compound, as is common with many organic compounds.

In summary, while specific solubility data may be limited, the structure of [2,5,7,8-tetramethyl-2-(4,8,12-trimethyltridecyl)chroman-6-yl] pyridine-3-carboxylate suggests a tendency toward solubility in non-polar to moderately polar solvents, with less affinity for aqueous environments. Thus, it is essential for users to consider the solvent system when working with this compound.

Interesting facts

Interesting Facts about [2,5,7,8-tetramethyl-2-(4,8,12-trimethyltridecyl)chroman-6-yl] pyridine-3-carboxylate

This compound belongs to a class of organic compounds known as chroman derivatives. It is particularly notable due to its intricate structure, which includes multiple methyl groups and a pyridine carboxylate moiety. Here are some fascinating points regarding this compound:

  • Biological Significance: Chroman derivatives are often studied for their biological activities, including antioxidant properties. This particular compound may exhibit potential protective effects against oxidative stress.
  • Structural Intricacies: The presence of both a chroman structure and a pyridine ring gives this compound unique chemical properties. The combination allows for varied reactions and interactions within biological systems.
  • Methyl Groups: The multiple methyl groups in its structure can enhance lipophilicity, influencing the compound's absorption and bioavailability in various environments.
  • Applications: Compounds with similar structures are often explored for applications in pharmaceuticals and as additives in food and cosmetics due to their functional benefits.
  • Synthetic Pathways: The synthesis of such a complex compound is an intriguing area of study. It typically requires multi-step reactions that can involve various reagents and techniques like chromatography for purification.
  • Research Potential: As a relatively complex synthetic compound, it offers numerous avenues for research in organic synthesis, medicinal chemistry, and material science.

In conclusion, the compound [2,5,7,8-tetramethyl-2-(4,8,12-trimethyltridecyl)chroman-6-yl] pyridine-3-carboxylate embodies a remarkable combination of structural elegance and potential utility. As research in the field progresses, further discoveries regarding its mechanisms and applications may unveil significant contributions to science and industry.

Synonyms
86362-36-9
EINECS 289-227-6
3,4-Dihydro-2,5,7,8-tetramethyl-2-(4,8,12-trimethyltridecyl)-2H-1-benzopyran-6-yl nicotinate
16676-75-8
3-Pyridinecarboxylic acid,(2R)-3,4-dihydro-2,5,7,8-tetramethyl-2-[(4R,8R)-4,8,12-trimethyltridecyl]-2H-1-benzopyran-6-yl ester, rel-
Hijuven
MFCD03548047
SCHEMBL73877
DTXSID40860600
BCP13683
AKOS015963784
Tocopherol nicotinate;Tocopherolnicotinate
[2,5,7,8-tetramethyl-2-(4,8,12-trimethyltridecyl)-3,4-dihydrochromen-6-yl] pyridine-3-carboxylate
NS00088172
NS00092269
[2R-2R*(4R*,8R*)]-3,4-Dihydro-2,5,7,8-tetramethyl-2-(4,8,12-trimethyltridecyl)-2H-1-benzopyran-6-ol nicotinate
2,5,7,8-Tetramethyl-2-(4,8,12-trimethyltridecyl)-3,4-dihydro-2H-1-benzopyran-6-yl pyridine-3-carboxylate
2,5,7,8-Tetramethyl-2-(4,8,12-trimethyltridecyl)-3,4-dihydro-2H-chromen-6-yl nicotinate #
289-227-6