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Benzbromarone

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Identification
Molecular formula
C23H20BrNO3
CAS number
3562-84-3
IUPAC name
3-[(2-tert-butylphenyl)-phenyl-methoxy]-9-methyl-9-azabicyclo[3.3.1]nonane
State
State
This compound is a solid under standard conditions, appearing as a white crystal.
Melting point (Celsius)
125.00
Melting point (Kelvin)
398.20
Boiling point (Celsius)
447.10
Boiling point (Kelvin)
720.30
General information
Molecular weight
421.56g/mol
Molar mass
421.5560g/mol
Density
1.1920g/cm3
Appearence
The compound typically appears as a white to off-white crystalline powder. It is solid at room temperature.
Comment on solubility

Solubility of 3-[(2-tert-butylphenyl)-phenyl-methoxy]-9-methyl-9-azabicyclo[3.3.1]nonane

The solubility of 3-[(2-tert-butylphenyl)-phenyl-methoxy]-9-methyl-9-azabicyclo[3.3.1]nonane can be categorized as follows:

  • Polarity: This compound features a complex structure with multiple aromatic rings, which can influence its overall polarity. Generally, compounds with significant aromatic character exhibit lower solubility in polar solvents.
  • Solvent Compatibility: It is likely to demonstrate higher solubility in:
    • Non-polar solvents (e.g., hexane, toluene) due to its extensive aromatic framework.
    • Organic solvents in general, as its complex structure may interact favorably with similar non-polar or moderately polar solvents.
  • Temperature Effects: Solubility may increase with temperature, which is a common behavior for many organic compounds.

In conclusion, while the exact solubility values for this compound are not readily available, its chemical structure suggests a tendency towards moderate solubility in organic solvents, especially those that are non-polar, allowing for optimal interactions and solvation.

Interesting facts

Interesting Facts About 3-[(2-tert-butylphenyl)-phenyl-methoxy]-9-methyl-9-azabicyclo[3.3.1]nonane

The compound known as 3-[(2-tert-butylphenyl)-phenyl-methoxy]-9-methyl-9-azabicyclo[3.3.1]nonane is a fascinating representative of synthetic chemistry, particularly within the realm of bicyclic structures.

Key Characteristics

  • Bicyclic Framework: This compound features a bicyclic nonane backbone, which is notable for its unique structural properties that can influence chemical reactivity.
  • Stereochemistry: As a bicyclic compound, it presents opportunities for interesting stereochemical considerations, which can lead to diverse isomeric forms.
  • Substitution Patterns: The presence of a tert-butyl group on a phenyl ring exemplifies how steric factors can significantly affect the compound's properties and reactivity.
  • Applications in Medicinal Chemistry: Compounds with similar structures have been explored for their potential applications in drug development and biological activities.

Research Insights

Within the field of chemistry, this compound raises several fascinating questions:

  • How does the bicyclic structure impact the compound's pharmacokinetic properties?
  • What are the implications of the tert-butyl substituent on the electronic characteristics and reactivity?
  • Can analogs of this compound be synthesized that may yield enhanced biological activity or selectivity?

The combination of its complex architecture and potential for biological significance makes 3-[(2-tert-butylphenyl)-phenyl-methoxy]-9-methyl-9-azabicyclo[3.3.1]nonane a subject of ongoing interest in chemistry research labs and pharmaceutical development. Its study not only paves the way for novel synthetic pathways but also contributes to the broader understanding of structure-activity relationships in chemical compounds.

Synonyms
KSD 2482
6606-02-6
BRN 1553504
N-Methyl-norgranatanol-3-alpha-(2-tert-butylbenzhydryl)aether [German]
3-alpha-(o-tert-Butyldiphenylmethoxy)-9-methyl-9-azabicyclo(3.3.1)nonane
9-AZABICYCLO(3.3.1)NONANE, 3-alpha-(o-tert-BUTYLDIPHENYLMETHOXY)-9-METHYL-
N-Methyl-norgranatanol-3-alpha-(2-tert-butylbenzhydryl)aether
DTXSID40984532
3-[(2-tert-butylphenyl)(phenyl)methoxy]-9-methyl-9-azabicyclo[3.3.1]nonane