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Dequalinium chloride

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Identification
Molecular formula
C30H40Cl2N4
CAS number
522-51-0
IUPAC name
2,4-dihydroxy-6-(hydroxymethyl)-6-methyl-2,4-dioxo-1,3,5,2lambda5,4lambda5-trioxadiphosphocan-7-ol
State
State

At room temperature, dequalinium chloride is in a solid crystalline state. It is stable under normal storage conditions but should be kept away from materials that might react with it chemically.

Melting point (Celsius)
260.00
Melting point (Kelvin)
533.15
Boiling point (Celsius)
300.00
Boiling point (Kelvin)
573.15
General information
Molecular weight
497.15g/mol
Molar mass
497.1530g/mol
Density
1.3900g/cm3
Appearence

Dequalinium chloride is typically a white to off-white crystalline powder. It is non-hygroscopic and odorless or has a slight odor. The compound is often encountered in a solid form at room temperature, although it may sometimes appear as small crystalline shards under certain preparations.

Comment on solubility

Solubility of 2,4-dihydroxy-6-(hydroxymethyl)-6-methyl-2,4-dioxo-1,3,5,2lambda5,4lambda5-trioxadiphosphocan-7-ol

The solubility of the compound 2,4-dihydroxy-6-(hydroxymethyl)-6-methyl-2,4-dioxo-1,3,5,2lambda5,4lambda5-trioxadiphosphocan-7-ol, with the chemical formula C30H40Cl2N4, is influenced by several factors:

  • Polarity: Given its multiple hydroxyl groups, this compound may exhibit increased polarity, enhancing its solubility in polar solvents like water.
  • Hydrogen bonding: The presence of hydroxyl (-OH) groups can facilitate hydrogen bonding with solvent molecules, further improving solubility.
  • Hybridization: The diverse chemical structure, characterized by multiple functional groups, may affect both solubility and interactions with other compounds.

However, despite these characteristics, certain factors might limit its solubility:

  • Hydrophobic regions: The compound possesses hydrophobic portions due to the presence of carbon chains, which can hinder interaction with polar solvents.
  • Concentration effects: As concentration increases, solubility might decrease due to aggregation or the formation of insoluble complexes.

In conclusion, while 2,4-dihydroxy-6-(hydroxymethyl)-6-methyl-2,4-dioxo-1,3,5,2lambda5,4lambda5-trioxadiphosphocan-7-ol is expected to exhibit moderate solubility characteristics, precise assessments will require experimental data to confirm its behavior in various solvents.

Interesting facts

Interesting Facts about 2,4-Dihydroxy-6-(hydroxymethyl)-6-methyl-2,4-dioxo-1,3,5,2lambda5,4lambda5-trioxadiphosphocan-7-ol

This complex compound, characterized by its multi-functional groups, presents numerous fascinating aspects that pique the interest of both chemists and students alike. Here are some noteworthy facts:

  • Multi-Functional Molecule: The presence of hydroxyl (–OH) and dioxo (C=O) groups allows this compound to engage in various chemical reactions, making it a versatile candidate in organic synthesis.
  • Phosphorus-containing Structure: The incorporation of phosphorus in its structure may grant this compound unique properties, potentially useful in fields such as agriculture and material science.
  • Biological Activity: Compounds resembling this structure are often explored for their biological properties, including antimicrobial and antioxidant activities.
  • Potential Applications: Given its complex nature, it could serve in applications ranging from pharmaceuticals to advanced materials. Research is often centered on understanding how the structural motifs influence its functional properties.
  • Chirality: The presence of multiple chiral centers in such compounds can lead to various stereoisomers, potentially impacting biological activity and reactivity.

As one delves deeper, it is essential to note that the synthesis of such compounds often requires advanced techniques and methodologies, showcasing the cutting-edge of synthetic organic chemistry. In the words of a renowned chemist, "The beauty of chemistry lies not just in the compounds themselves, but in the stories they tell through their interactions and transformations."
Exploring this compound paves the way for exciting discoveries and innovations!

Synonyms
Mbtcpp
141816-32-2
2-C-Methyl-D-erythritol-2,4-cyclopyrophosphate
2-Methyl-butan-1,2,3,4-tetraol-2,4-cyclopyrophosphate
2,4-dihydroxy-6-(hydroxymethyl)-6-methyl-2,4-dioxo-1,3,5,2lambda5,4lambda5-trioxadiphosphocan-7-ol
2,4,7-Trihydroxy-6-methyl-1,3,5,2,4-trioxadiphosphene-6-methanol 2,4-dioxide
2-C-Methyl-D-erythritol 1,2-cyclophosphate 4-phosphate
1,3,5,2,4-Trioxadiphosphene-6-methanol, 2,4,7-trihydroxy-6-methyl-, 2,4-dioxide
151435-51-7
6-(hydroxymethyl)-6-methyl-1,3,5,2,4-trioxadiphosphocane-2,4,7-triol 2,4-dioxide
DTXSID10931210
PD040318
Q2813809