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Trospium chloride

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Identification
Molecular formula
C25H30ClNO3
CAS number
10405-02-4
IUPAC name
(9-ethyl-9-methyl-3-oxa-9-azoniatricyclo[3.3.1.02,4]nonan-7-yl) 3-hydroxy-2-phenyl-propanoate
State
State

Trospium chloride is a solid at room temperature.

Melting point (Celsius)
204.00
Melting point (Kelvin)
477.15
Boiling point (Celsius)
232.00
Boiling point (Kelvin)
505.15
General information
Molecular weight
427.97g/mol
Molar mass
427.9740g/mol
Density
1.2300g/cm3
Appearence

Trospium chloride is a white crystalline powder. It is odorless and has a bitter taste.

Comment on solubility

Solubility of (9-ethyl-9-methyl-3-oxa-9-azoniatricyclo[3.3.1.02,4]nonan-7-yl) 3-hydroxy-2-phenyl-propanoate

The solubility of the compound (9-ethyl-9-methyl-3-oxa-9-azoniatricyclo[3.3.1.02,4]nonan-7-yl) 3-hydroxy-2-phenyl-propanoate, with the formula C25H30ClNO3, can be quite complex given its unique structural characteristics.

When studying solubility, several factors come into play:

  • Polarity: The presence of functional groups such as hydroxyl (–OH) and the cationic azonia group influences the polarity of the molecule, which typically increases its solubility in polar solvents like water.
  • Hydrogen bonding: The hydroxy group can engage in hydrogen bonding, enhancing solubility in protic solvents.
  • Solvent compatibility: Compatibility with organic solvents (ethanol, methanol) may also be significant due to the large hydrophobic phenyl group.
  • Ionization: The azonia component suggests ionization in solution, affecting solubility based on pH and concentration.

In practical terms, the compound may exhibit:

  • High solubility in polar solvents due to hydrogen bonding.
  • Moderate solubility in organic solvents, influenced by the nonpolar sections.

In conclusion, the solubility profile of (9-ethyl-9-methyl-3-oxa-9-azoniatricyclo[3.3.1.02,4]nonan-7-yl) 3-hydroxy-2-phenyl-propanoate is determined by its complex structure, with expected behaviors of varying degrees across different solvent environments. It is clear that while it may be readily soluble in specific conditions, the precise solubility must be determined experimentally to ensure accurate usage in applications.

Interesting facts

Interesting Facts about (9-ethyl-9-methyl-3-oxa-9-azoniatricyclo[3.3.1.02,4]nonan-7-yl) 3-hydroxy-2-phenyl-propanoate

(9-ethyl-9-methyl-3-oxa-9-azoniatricyclo[3.3.1.02,4]nonan-7-yl) 3-hydroxy-2-phenyl-propanoate is a fascinating compound in the realm of organic chemistry due to its unique structural features and potential applications. Here are some noteworthy aspects:

  • Unique Structure: The compound exhibits a complex tricyclic structure, which contributes to its chemical properties and reactivity. The presence of a heteroatom, such as oxygen in the oxazoniatricycle, enhances its versatility in various chemical reactions.
  • Potential Therapeutic Uses: Compounds with similar structures have been investigated for their pharmacological activities, which may include anti-inflammatory, analgesic, or antimicrobial properties. The phenyl group in its structure often participates in significant biological interactions.
  • Chirality: The presence of chiral centers in the molecule may lead to different stereoisomers, which can exhibit distinct biological activities. This chirality is crucial in drug design, where the efficacy of a compound can be highly dependent on its stereochemistry.
  • Reactivity: The functional groups within the compound, such as hydroxy and azoniatricyclic motifs, can undergo a variety of chemical reactions including substitutions and rearrangements, making them subjects of interest in synthetic organic chemistry.
  • Applications in Research: Due to its structural complexity, this compound serves as an intriguing model in studies focused on the interactions between organic structures and biological systems. It can be used to explore the synthesis of novel compounds with tailored properties for specific applications.

In summary, (9-ethyl-9-methyl-3-oxa-9-azoniatricyclo[3.3.1.02,4]nonan-7-yl) 3-hydroxy-2-phenyl-propanoate is an exemplar of synthetic organic chemistry that encapsulates the intersection of structure, function, and potential utility in various fields ranging from medicinal chemistry to material science. As research continues, compounds of this nature may pave the way for innovative solutions in therapeutic development and beyond.

Synonyms
SCHEMBL3312795
DTXSID40860448
NS00009394
9-Ethyl-7-[(3-hydroxy-2-phenylpropanoyl)oxy]-9-methyl-3-oxa-9-azatricyclo[3.3.1.0~2,4~]nonan-9-ium