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Tamoxifen

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Identification
Molecular formula
C26H29NO2
CAS number
10540-29-1
IUPAC name
3-[1-[4-[2-(dimethylamino)ethoxy]phenyl]-2-phenyl-but-1-enyl]phenol
State
State

Tamoxifen is usually in a solid state at room temperature, appearing as white crystalline powder. It is stable under normal conditions of use and storage.

Melting point (Celsius)
140.00
Melting point (Kelvin)
413.15
Boiling point (Celsius)
613.45
Boiling point (Kelvin)
886.60
General information
Molecular weight
563.68g/mol
Molar mass
563.6780g/mol
Density
1.1169g/cm3
Appearence

Tamoxifen typically appears as a white to off-white crystalline powder. It is practically insoluble in water but soluble in methanol, ethanol, and organic solvents like dichloromethane.

Comment on solubility

Solubility of 3-[1-[4-[2-(dimethylamino)ethoxy]phenyl]-2-phenyl-but-1-enyl]phenol

The compound 3-[1-[4-[2-(dimethylamino)ethoxy]phenyl]-2-phenyl-but-1-enyl]phenol, with the chemical formula C26H29NO2, presents interesting characteristics regarding its solubility. Here are some important considerations:

  • Solvent Polarity: The solubility of this compound is likely influenced by the polarity of the solvent it is placed in. A polar solvent, such as water, may not dissolve this compound sufficiently due to its largely nonpolar structure.
  • Hydrophobic Interactions: With a significant presence of carbon and aromatic groups, this compound may exhibit hydrophobic interactions, making it more soluble in organic solvents like ethanol or dimethyl sulfoxide (DMSO).
  • Amine Group Influence: The presence of the dimethylamino group could enhance solubility in certain conditions, particularly in acidic or basic environments that can enhance interactions through protonation or deprotonation.
  • Structure-Activity Relationship: The steric and electronic effects of various substituents can significantly impact solubility patterns; hence, predicting solubility behavior requires a detailed understanding of intermolecular forces.

In conclusion, while 3-[1-[4-[2-(dimethylamino)ethoxy]phenyl]-2-phenyl-but-1-enyl]phenol is expected to have limited solubility in water due to its substantial hydrophobic regions, it may exhibit better solubility in more nonpolar organic solvents. The exact values and conditions of solubility would require experimental determination for precise applications and uses.

Interesting facts

Interesting Facts about 3-[1-[4-[2-(dimethylamino)ethoxy]phenyl]-2-phenyl-but-1-enyl]phenol

This compound, with its complex structure, is part of a fascinating class of organic compounds known as arylphenols. These types of compounds often exhibit significant biological activity, making them of great interest in various fields of research, especially medicinal chemistry.

Key Attributes

  • Biological Importance: Compounds like this one are often investigated for their potential therapeutic effects. They can serve as frameworks for the development of drugs targeting various diseases.
  • Structural Diversity: The presence of both aryl and aliphatic segments in the molecular structure provides intriguing opportunities for exploring structure-activity relationships (SAR).
  • Synthetic Versatility: The synthetic pathways to create such complex compounds can reveal valuable techniques in organic synthesis, showcasing the beauty and intricacy of chemical reactions.
  • Dimethylamino Group: The inclusion of a dimethylamino group may enhance solubility and bioavailability, which are critical factors in drug design.

Applications and Research Potential

Researchers are continuously exploring how modifications to the phenolic and dimethylamino moieties can lead to compounds with improved pharmacological profiles. Significant areas of research include:

  • Anticancer agents
  • Antimicrobial properties
  • Neurological applications

As a chemistry student, delving into such compounds can sharpen analytical skills, familiarizing you with advanced characterization methods like NMR and mass spectrometry, further enriching your understanding of organic chemistry.

In summary, 3-[1-[4-[2-(dimethylamino)ethoxy]phenyl]-2-phenyl-but-1-enyl]phenol is not only a complex structure but also a promising lead in the journey toward innovative therapeutic strategies. The exploration of its properties and potential applications continues to inspire those in the scientific community.

Synonyms
83647-29-4
3-(1-{4-[2-(dimethylamino)ethoxy]phenyl}-2-phenylbut-1-en-1-yl)phenol
DTXSID20274463
ZQZFYGIXNQKOAV-UHFFFAOYSA-N
DB-046358