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1-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)azepane

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Identification
Molecular formula
C14H21NO2
CAS number
: 125514-71-8
IUPAC name
1-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)azepane
State
State

1-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)azepane is typically a liquid at room temperature, indicating its relatively low melting point.

Melting point (Celsius)
-2.00
Melting point (Kelvin)
271.15
Boiling point (Celsius)
356.00
Boiling point (Kelvin)
629.15
General information
Molecular weight
235.31g/mol
Molar mass
235.3060g/mol
Density
1.1083g/cm3
Appearence

The compound appears as a colorless to pale yellow liquid at room temperature. Its structure includes a benzodioxin ring fused with an azepane ring, contributing to its appearance and properties.

Comment on solubility

Solubility of 1-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)azepane

The solubility of 1-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)azepane presents some interesting characteristics influenced by its chemical structure. This compound features a complex heterocyclic structure, which can affect its interaction with solvents. Let's explore some aspects of its solubility:

  • Polar vs. Nonpolar Solvents: Given the presence of both polar (aromatic dioxin) and nonpolar (azepane) characteristics in its structure, this compound may exhibit solubility in a range of solvents. However, it is expected to show higher solubility in polar organic solvents such as ethanol or methanol.
  • Hydrogen Bonding: The potential for hydrogen bonding due to functional groups in the molecule may enhance its solubility in polar solvents, allowing for better interactions with solvent molecules.
  • Temperature Considerations: Solubility can also vary with temperature. Typically, increasing temperature can enhance the solubility of organic compounds, as molecular motion increases and disrupts intermolecular attractions.
  • pH Dependence: For certain compounds, solubility is influenced by the pH of the solution. Although this specific compound may not have significant acidic or basic groups, it is advantageous to consider environmental pH when predicting solubility.

In summary, while there isn't a wealth of readily available data on the solubility of 1-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)azepane, engaging with its structure reveals several intriguing factors that can influence how it interacts with different solvents. Thus, this compound is likely to be soluble in polar organic solvents under suitable conditions, but empirical testing would be essential for precise solubility information.

Interesting facts

Interesting Facts about 1-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)azepane

1-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)azepane is a fascinating compound that exhibits a unique structure and potential applications in various fields of chemistry and pharmacology. Here are some noteworthy points about this intriguing compound:

  • Structural Complexity: The compound features a combination of a bicyclic benzodioxin moiety and a seven-membered azepane ring, showcasing the rich diversity of organic molecules.
  • Potential Biological Activity: Compounds containing benzodioxin frameworks have been studied for their pharmacological properties, including anti-inflammatory and analgesic effects.
  • Synthetic Versatility: The azepane ring adds to the compound's versatility in chemical synthesis, as it can serve as a scaffold for further modifications or functionalization.
  • Research Interest: Chemists are continually exploring benzodioxin derivatives in drug discovery, leading to the potential development of new therapeutics.
  • Interdisciplinary Relevance: The compound's unique characteristics make it of interest not only in organic chemistry but also in fields like medicinal chemistry, materials science, and biochemistry.

As noted by one researcher, “The interplay between structure and biological activity in compounds like this continues to amaze us, offering promise for future innovations.”
With its intriguing chemical architecture, 1-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)azepane represents yet another example of how complex compounds can lead to significant advancements in both scientific understanding and practical applications.

Synonyms
BRN 1648769
3653-40-5
2-(1,4-Benzodioxan-2-ylmethyl)hexahydro-1H-azepine
Hexamethylenimine, 1-(1,4-benzodioxin-2-ylmethyl)-
5-20-04-00056 (Beilstein Handbook Reference)
1H-AZEPINE, HEXAHYDRO-1-(1,4-BENZODIOXAN-2-YLMETHYL)-
1H-Azepine, 1-((2,3-dihydro-1,4-benzodioxin-2-yl)methyl)hexahydro-
1H-Azepine, 1-((2,3-dihydro-1,4-benzodioxin-2-yl)methyl)hexahydro-(9CI)
Oprea1_266008
DTXSID10957834
1-[(2,3-Dihydro-1,4-benzodioxin-2-yl)methyl]azepane