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Bromoxynil octanoate

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Identification
Molecular formula
C16H17BrO2
CAS number
82012-44-4
IUPAC name
6-(bromomethylene)-3-(1-naphthyl)tetrahydropyran-2-one
State
State

This compound is typically found in a solid state at room temperature.

Melting point (Celsius)
157.00
Melting point (Kelvin)
430.15
Boiling point (Celsius)
300.00
Boiling point (Kelvin)
573.15
General information
Molecular weight
343.16g/mol
Molar mass
343.1620g/mol
Density
1.5730g/cm3
Appearence

This compound is typically a colorless to pale yellow solid. It may appear as crystals or crystalline powder depending on the level of purity and method of crystallization.

Comment on solubility

Solubility of 6-(bromomethylene)-3-(1-naphthyl)tetrahydropyran-2-one

Understanding the solubility of 6-(bromomethylene)-3-(1-naphthyl)tetrahydropyran-2-one (C16H17BrO2) is critical for both its practical applications and synthesis. Solubility can be influenced by various factors, which can be outlined as follows:

  • Polarity: The presence of polar functional groups typically enhances solubility in polar solvents, such as water. However, in this compound, the bromine and naphthyl groups may introduce a level of hydrophobicity.
  • Hydrogen Bonding: Functional groups capable of hydrogen bonding can significantly improve solubility in protic solvents. In this case, the keto group might engage in hydrogen bonding with water to some extent.
  • Temperature: As temperature increases, solubility often increases for many compounds. It’s essential to consider the thermal stability of the compound at elevated temperatures.
  • Solvent Polarity: The choice of solvent is crucial. While the compound may have limited solubility in water, it could show greater solubility in organic solvents like ethanol or acetone due to its non-polar characteristics.

In general, it would be wise to evaluate solubility through experimental means, as theoretical predictions may be limited by complex interactions between molecular structures and solvent properties. As a rule of thumb, “[Solubility is not just a property; it is a process influenced by molecular interactions.]”
Therefore, detailed studies on 6-(bromomethylene)-3-(1-naphthyl)tetrahydropyran-2-one in various solvents are recommended to fully understand its solubility profile.

Interesting facts

Interesting Facts about 6-(Bromomethylene)-3-(1-naphthyl)tetrahydropyran-2-one

This intriguing compound, 6-(bromomethylene)-3-(1-naphthyl)tetrahydropyran-2-one, belongs to the class of oxo-heterocycles and is notable for its unique structural features. Here are some key points to highlight:

  • Structural Complexity: The presence of both a tetrahydropyran ring and a naphthyl group contributes to the compound's intricate structure, making it a point of interest for synthetic chemists.
  • Reactivity: The bromomethylene functional group can engage in various nucleophilic reactions, allowing the compound to be utilized in different synthetic pathways. This makes it a versatile building block in organic synthesis.
  • Biological Activity: Compounds with similar tetrahydropyran structures have been studied for their potential biological activities, including anticancer and antimicrobial properties. This suggests that further research into this compound could uncover valuable applications in pharmaceuticals.
  • Synthetic Utility: The synthesis of this compound offers opportunities to develop novel methodologies in organic chemistry, particularly in the area of creating functionalized tetrahydropyrans and other heterocycles.

Moreover, the unique combination of a bromomethylene group and a naphthyl moiety sets the stage for innovative research and applications, reflecting the ever-evolving landscape of organic chemistry. As we continue to explore compounds like this one, we uncover new opportunities that could lead to advancements in both chemical synthesis and material science.

Synonyms
144298-62-4
(6E)-Bromoenol lactone
2H-Pyran-2-one, 6-(bromomethylene)tetrahydro-3-(1-naphthalenyl)-
(6Z)-6-(bromomethylidene)-3-(naphthalen-1-yl)oxan-2-one
6-(Bromomethylene)-3-(naphthalen-1-yl)tetrahydro-2H-pyran-2-one
DTXSID40274369
DS-000059
NS00016749
2H-pyran-2-one, 6-(bromomethylene)tetrahydro-3-(1-naphthalenyl)-,(3s,6e)-