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Identification
Molecular formula
C21H36ClNO2
CAS number
9004-82-2
IUPAC name
2-(8-tert-butyl-1,4-dioxaspiro[4.5]decan-3-yl)piperidin-1-ium;chloride
State
State

At room temperature, the compound is a solid.

Melting point (Celsius)
180.00
Melting point (Kelvin)
453.15
Boiling point (Celsius)
300.00
Boiling point (Kelvin)
573.15
General information
Molecular weight
380.87g/mol
Molar mass
380.8700g/mol
Density
1.1400g/cm3
Appearence

The compound appears as a white to off-white crystalline powder.

Comment on solubility

Solubility Insights for 2-(8-tert-butyl-1,4-dioxaspiro[4.5]decan-3-yl)piperidin-1-ium;chloride

The solubility of 2-(8-tert-butyl-1,4-dioxaspiro[4.5]decan-3-yl)piperidin-1-ium;chloride can be influenced by various factors including its molecular structure and the presence of the chloride ion.

Key Factors Affecting Solubility:

  • Ionic Nature: As a chloride salt, this compound is likely to exhibit good solubility in polar solvents, particularly water, due to the ionic interactions.
  • Polar and Nonpolar Interactions: The presence of bulky tert-butyl groups may hinder solubility in nonpolar solvents, as larger hydrocarbon groups typically disrupt hydrogen bonding.
  • Temperature Dependency: Like many ionic compounds, solubility may increase with temperature, allowing for better dissolution in aqueous solutions.
  • pH Sensitivity: The solubility might also be affected by the pH of the solution, especially since piperidinium salts can be influenced by protonation states.

In summary, this compound is expected to have improved solubility in water and other polar solvents due to its ionic character. However, the bulky nonpolar groups may pose limitations in certain organic solvents, leading to varied solubility profiles depending on environmental conditions.

Interesting facts

Interesting Facts About 2-(8-tert-butyl-1,4-dioxaspiro[4.5]decan-3-yl)piperidin-1-ium;chloride

This compound, often referred to in the realm of organic chemistry, showcases a unique structure that contributes to its distinctive properties and potential applications. Here are some intriguing insights:

  • Versatile Parent Structure: The piperidine moiety is a crucial element of this compound, making it a nitrogen-containing heterocycle that is commonly found in various pharmaceuticals. This feature highlights its importance in medicinal chemistry.
  • Spiral Dynamics: The term “spiro” in the name indicates a spirocyclic compound, demonstrating a unique bonding arrangement where two rings share a single atom. This geometric configuration can lead to interesting stereochemistry and physical properties.
  • Functional Groups: The presence of the dioxaspiro group adds complexity to the structure, exhibiting both ether and carbonyl functionalities that might influence the reactivity and stability of the compound.
  • Potential Applications: Compounds with a similar structural framework are often investigated for their biological activities. This could imply potential applications in drug design, where modifications to the structure could optimize interactions with biological targets.
  • Research Implications: The exploration of ionic compounds such as this chloride salt may provide insights into ionic interactions in biological systems, potentially influencing the design of better therapeutic agents.

In conclusion, 2-(8-tert-butyl-1,4-dioxaspiro[4.5]decan-3-yl)piperidin-1-ium;chloride is an illuminating example of how structural complexity in organic compounds can lead to diverse possibilities in both academic research and practical applications. Its intricate design warrants further study, particularly in fields like pharmacology and materials science.

Synonyms
alpha-8-tert-Butyl-2-(2-piperidyl)-1,4-dioxaspiro(4.5)decane hydrochloride
1,4-DIOXASPIRO(4.5)DECANE, 8-tert-BUTYL-2-(2-PIPERIDYL)-, HYDROCHLORIDE, alpha-
7538-24-1