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Brominated Butylmethoxyisoquinolinium

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Identification
Molecular formula
C15H20BrNO3
CAS number
1019354-68-3
IUPAC name
6-butyl-4-methoxy-[1,3]dioxolo[4,5-g]isoquinolin-6-ium;bromide
State
State

At room temperature, the compound remains in a solid state, which is typical for many brominated organic salts.

Melting point (Celsius)
288.00
Melting point (Kelvin)
561.15
Boiling point (Celsius)
440.00
Boiling point (Kelvin)
713.15
General information
Molecular weight
357.24g/mol
Molar mass
357.2380g/mol
Density
2.3200g/cm3
Appearence

The compound is typically found as a crystalline solid. It can appear off-white or pale yellow, depending on purity and specific conditions such as hydration or crystalline habits.

Comment on solubility

Solubility of 6-butyl-4-methoxy-[1,3]dioxolo[4,5-g]isoquinolin-6-ium Bromide

The solubility of 6-butyl-4-methoxy-[1,3]dioxolo[4,5-g]isoquinolin-6-ium bromide is a multifaceted topic that can vary depending on several factors. Understanding the solubility of this compound requires consideration of its unique structural characteristics:

  • Ionic Nature: The presence of the bromide ion suggests that the compound may exhibit high solubility in polar solvents such as water.
  • Substituents: The butyl and methoxy groups can impact solubility, potentially enhancing the compound's solubility in organic solvents.
  • Temperature Dependence: Like many chemical compounds, solubility may increase with temperature, a key factor to consider during experimental procedures.

In practical terms, this means that:

  • The compound is likely to dissolve well in alcohols and other polar organic solvents.
  • In addition, lower solubility might be observed in non-polar solvents due to steric hindrance from the bulky substituents.

To summarize, the solubility of 6-butyl-4-methoxy-[1,3]dioxolo[4,5-g]isoquinolin-6-ium bromide can be described as:

  • Good in polar solvents.
  • Reduced in non-polar environments.
  • Temperature-sensitive, making solubility evaluations context-dependent.

Understanding these solubility characteristics is crucial for applications involving this compound, particularly in drug formulation and chemical synthesis.

Interesting facts

Interesting Facts about 6-butyl-4-methoxy-[1,3]dioxolo[4,5-g]isoquinolin-6-ium Bromide

This intriguing compound, 6-butyl-4-methoxy-[1,3]dioxolo[4,5-g]isoquinolin-6-ium bromide, falls within a unique class of isoquinolinium derivatives. These types of compounds are noted for their diverse biological activities, which make them a significant area of research in pharmaceuticals. Here are some fascinating points to consider:

  • Structural Complexity: The compound's *dioxolo* structure contributes to its intriguing properties, owing to the bridging effects that can influence electron distribution within the molecule.
  • Bioactivity: Many isoquinolinium derivatives, like this one, are examined for their potential anti-inflammatory and anti-cancer properties, making them promising candidates for drug development.
  • Quaternization: As a quaternary ammonium compound, it possesses unique ionic characteristics, which can enhance its solubility in aqueous environments, important for biological systems.
  • Applications in Material Science: Beyond pharmacology, compounds with similar structures have been investigated for applications in materials science, particularly in the development of electroactive materials.
  • Substitution Variability: The variability in substitution patterns, such as the butyl and methoxy groups in this compound, allows for the exploration of how different functional groups can affect biological activity and solubility.

Furthermore, experimental studies exploring the interactions between this compound and biological targets can provide valuable insights into its mechanism of action. As scholars continue to scrutinize the rich tapestry of isoquinolinium chemistry, compounds like 6-butyl-4-methoxy-[1,3]dioxolo[4,5-g]isoquinolin-6-ium bromide certainly hold the potential for groundbreaking discoveries!

Synonyms
6-Butyl-4-methoxy-1,3-dioxolo(4,5-g)isoquinolinium bromide
15248-44-9
1,3-DIOXOLO(4,5-g)ISOQUINOLINIUM, 6-BUTYL-4-METHOXY-, BROMIDE
DTXSID40934512
(6-Butyl-2H-[1,3]dioxolo[4,5-g]isoquinolin-4(6H)-ylidene)(methyl)oxidanium bromide