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Harmane

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Identification
Molecular formula
C15H18Cl2N2O
CAS number
343-27-1
IUPAC name
diethyl-[2-[(7-oxocyclohepta-1,3,5-trien-1-yl)ammonio]ethyl]ammonium;dichloride
State
State

The compound is typically a solid at room temperature.

Melting point (Celsius)
246.00
Melting point (Kelvin)
519.15
Boiling point (Celsius)
350.00
Boiling point (Kelvin)
623.15
General information
Molecular weight
248.18g/mol
Molar mass
248.1820g/mol
Density
1.2040g/cm3
Appearence

In its pure form, this compound appears as a white to off-white crystalline solid. It is capable of forming hygroscopic crystals.

Comment on solubility

Solubility of Diethyl-[2-[(7-oxocyclohepta-1,3,5-trien-1-yl)ammonio]ethyl]ammonium; Dichloride

The solubility of the compound diethyl-[2-[(7-oxocyclohepta-1,3,5-trien-1-yl)ammonio]ethyl]ammonium dichloride can be understood by considering several key factors:

  • Ionic Nature: As a quaternary ammonium salt, this compound is likely to be soluble in polar solvents, primarily water, due to the ionic interactions between the ammonium group and water molecules.
  • Influence of Chloride Ions: The presence of dichloride indicates that it can dissociate into ions in solution, which generally enhances solubility.
  • Hydrophobic Regions: The hydrophobic cycloheptatriene moiety may contribute to lower solubility in non-polar solvents. Thus, it is expected to have limited solubility in organic solvents like hexane or toluene.
  • Temperature Effect: Increased temperature may improve solubility by providing enough kinetic energy for the ions to overcome lattice energy and solvate effectively.

Overall, while diethyl-[2-[(7-oxocyclohepta-1,3,5-trien-1-yl)ammonio]ethyl]ammonium dichloride is expected to be soluble in water due to its ionic nature, its solubility can vary greatly depending on specific environmental conditions and the medium used. As such, the careful choice of solvent is pivotal for dissolving this compound.

Interesting facts

Interesting Facts about Diethyl-[2-[(7-oxocyclohepta-1,3,5-trien-1-yl)ammonio]ethyl]ammonium; Dichloride

This intriguing compound is a member of a fascinating class of chemical compounds known as quaternary ammonium salts. Its complex structure highlights the rich interplay between organic chemistry and medicinal applications.

Key Highlights:

  • Structural Diversity: The presence of the 7-oxocyclohepta-1,3,5-trien-1-yl moiety contributes to its unique properties, making it an interesting subject for study in organic synthesis and medicinal chemistry.
  • Potential Applications: Compounds like this one are often explored for their potential use in drug delivery systems and antimicrobial agents due to their ability to interact with biological membranes.
  • Quaternization: The quaternary ammonium structure is crucial as it often enhances solubility in biological systems and can lead to increased stability compared to primary or secondary amines.
  • Research Interest: Scientists are increasingly interested in the synthesis pathways of such compounds, as they can lead to new methods for creating effective pharmaceuticals.
  • Reactivity: The presence of both ammonium and halide ions in this compound indicates a potential for interesting reactivity under certain conditions, making it a valuable compound for research in reaction mechanisms.

In conclusion, diethyl-[2-[(7-oxocyclohepta-1,3,5-trien-1-yl)ammonio]ethyl]ammonium; dichloride is more than just a complex name; it represents a gateway to numerous explorations in the realm of chemistry, with implications spanning from drug design to understanding molecular interactions. As you delve deeper into its properties and possibilities, it becomes clear that the mysteries of this compound are worth exploring.

Synonyms
2-(beta-Diethylaminoethylamino)tropone dihydrochloride
2-((2-(Diethylamino)ethyl)amino)-2,4,6-cycloheptatrien-1-one dihydrochloride
2,4,6-CYCLOHEPTATRIEN-1-ONE, 2-((2-(DIETHYLAMINO)ETHYL)AMINO)-, DIHYDROCHLORIDE
18189-47-4