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Tetrodotoxinin 1

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Identification
Molecular formula
C20H38Br2N4O2P2
CAS number
1406-86-8
IUPAC name
2-(diisopropoxyphosphorylamino)ethyl-[6-[2-(diisopropoxyphosphorylamino)ethyl-dimethyl-ammonio]hexyl]-dimethyl-ammonium;dibromide
State
State

The compound is typically solid at room temperature.

Melting point (Celsius)
252.00
Melting point (Kelvin)
525.15
Boiling point (Celsius)
200.00
Boiling point (Kelvin)
473.15
General information
Molecular weight
703.63g/mol
Molar mass
703.6260g/mol
Density
1.1607g/cm3
Appearence

The compound is typically a white to off-white crystalline powder. It is usually solid at room temperature and is highly soluble in water.

Comment on solubility

Solubility of 2-(diisopropoxyphosphorylamino)ethyl-[6-[2-(diisopropoxyphosphorylamino)ethyl-dimethyl-ammonio]hexyl]-dimethyl-ammonium; dibromide

The solubility of the compound 2-(diisopropoxyphosphorylamino)ethyl-[6-[2-(diisopropoxyphosphorylamino)ethyl-dimethyl-ammonio]hexyl]-dimethyl-ammonium; dibromide can be characterized by several important factors:

  • Ionic Nature: As a quaternary ammonium salt, it typically exhibits high solubility in polar solvents such as water due to its ionic interactions.
  • Hydrophilic Groups: The presence of multiple amino and phosphoryl groups enhances its interaction with water, further increasing its solubility.
  • Polar Functionalities: The diisopropoxy groups contribute to its hydrophilicity, providing sites for hydrogen bonding, which generally augments solubility in aqueous environments.

In practical terms, this compound can be expected to dissolve readily in aqueous solutions, which may be crucial for its applications in fields requiring high bioavailability of the active substance. Moreover, it is important to consider the solubility behavior across varying pH levels and the potential for interactions with other molecular species present in a solution.

According to solubility theory, "Like dissolves like," and as such, the presence of polar features in this compound suggests a likely compatibility with polar solvents. However, further experimental investigation would be essential to quantify the exact solubility metrics under defined conditions.

Interesting facts

Interesting Facts about 2-(diisopropoxyphosphorylamino)ethyl-[6-[2-(diisopropoxyphosphorylamino)ethyl-dimethyl-ammonio]hexyl]-dimethyl-ammonium;dibromide

This unique compound belongs to a class of quaternary ammonium salts, noted for their versatility and applications in various fields.

Key Characteristics:

  • Dual functionality: The presence of both phosphorylamino groups and quaternary ammonium groups allows for diverse biological activity, making it interesting for pharmaceutical research.
  • Stability: Quaternary ammonium salts are generally known for their thermal and chemical stability, which is crucial for applications in drug formulation and delivery systems.
  • Biocompatibility: The diisopropoxyphosphoryl moieties may enhance biocompatibility, attracting interest for use in medicinal chemistry and biochemistry.

Researchers are particularly intrigued by its potential as a drug delivery agent. Its structural complexity can promote interactions with cellular membranes, enabling targeted therapeutic effects. This compound exemplifies how modifications at the molecular level can yield compounds with enhanced functionality.

Applications and Research Areas:

  • Drug delivery systems: Researchers explore its capacity to facilitate the transport of therapeutic agents across cell membranes.
  • Agricultural chemistry: Similar compounds are often investigated for their potential as surfactants or herbicides.
  • Biological studies: The dual functional groups may allow for targeted studies of cellular mechanisms and pathways.

In conclusion, the intriguing nature of 2-(diisopropoxyphosphorylamino)ethyl-[6-[2-(diisopropoxyphosphorylamino)ethyl-dimethyl-ammonio]hexyl]-dimethyl-ammonium;dibromide lies in its structural versatility and potential applications across various fields, making it a significant compound for further research and development.

Synonyms
9019 HC
20021-05-0
Hexamethylenebis(dimethyl(2-(diisopropylphosphonoamino)ethyl)ammonium bromide)
Ammonium, hexamethylenebis(dimethyl(2-(phosphonoamino)ethyl)-, dibromide, tetraisopropyl ester
RefChem:319393
DTXSID60942018
N~1~,N~6~-Bis[2-({bis[(propan-2-yl)oxy]phosphoryl}amino)ethyl]-N~1~,N~1~,N~6~,N~6~-tetramethylhexane-1,6-bis(aminium) dibromide