N-[(5-bromo-2-methoxy-phenyl)methyl]-2-chloro-N-(2-chloroethyl)ethanamine

Identification

Molecular formula

C₁₂H₁₆BrCl₂NO

CAS number

118920-09-9

IUPAC name

N-[(5-bromo-2-methoxy-phenyl)methyl]-2-chloro-N-(2-chloroethyl)ethanamine

State

At room temperature, this compound is typically found in a liquid state, although it can crystallize under certain conditions such as variations in temperature and pressure.

Melting point (Celsius)

21.20

Melting point (Kelvin)

294.35

Boiling point (Celsius)

355.70

Boiling point (Kelvin)

628.85

General information

Molecular weight

336.58g/mol

Molar mass

336.5800g/mol

Density

1.4760g/cm³

Appearence

The compound typically appears as a colorless to slightly yellow, viscous liquid. It may also be found in a crystalline form depending on the specific conditions such as purity and temperature.

Comment on solubility

Solubility of N-[(5-bromo-2-methoxy-phenyl)methyl]-2-chloro-N-(2-chloroethyl)ethanamine

The solubility of N-[(5-bromo-2-methoxy-phenyl)methyl]-2-chloro-N-(2-chloroethyl)ethanamine can be influenced by several factors including structure and polarity.

Factors Affecting Solubility:

Polarity: The presence of both chloro and methoxy groups in the structure affects the overall polarity of this compound. Generally, polar compounds tend to be more soluble in polar solvents.
Hydrogen Bonding: The ability of a compound to engage in hydrogen bonding can enhance solubility in certain solvents, particularly when hydroxyl or amine groups are present. In this case, the structure lacks hydroxyl groups, which may limit solubility.
Crystal Lattice Energy: If the molecule forms strong intermolecular interactions in crystal form, it may be less soluble due to high lattice energy requiring more energy input to dissolve.

In summary: While specific solubility data may be limited, the overall expectation is that this compound may have low to moderate solubility in polar solvents due to its unique structural features. It is advisable to conduct experimental solubility testing to ascertain precise solubility characteristics in various solvents.

Interesting facts

Interesting Facts about N-[(5-bromo-2-methoxy-phenyl)methyl]-2-chloro-N-(2-chloroethyl)ethanamine

This compound, known for its intricate molecular structure, belongs to a class of chemicals that are crucial in medicinal chemistry. Here are some fascinating insights:

Pharmacological Potential: Given its structural features, this compound may exhibit properties that are beneficial in drug development, particularly for targeting specific biological pathways.
Substituent Influence: The presence of bromo and methoxy groups on the phenyl ring is significant as these functional groups can affect the compound’s reactivity and biological activity. The substitutions can enhance lipophilicity, making the compound more effective as a drug.
Synthesis Challenges: The synthesis of such compounds can be quite complex, often requiring careful planning and execution to ensure high yields and purity. This aspect makes it an interesting subject for synthetic chemists.
Research Implications: Compounds with chlorinated and bromo-substituents have been studied for their potential anti-cancer properties, which makes this compound a candidate for further research in oncology.

As chemists delve deeper into the properties and applications of this compound, they remain energized by the potential discoveries that can emerge. The connection between structure and function exemplifies the beauty of chemistry: "From the smallest changes in molecular architecture arise the greatest differences in biological activity."

Overall, N-[(5-bromo-2-methoxy-phenyl)methyl]-2-chloro-N-(2-chloroethyl)ethanamine exemplifies the intersection between organic synthesis and medicinal applications, highlighting how detailed knowledge of compounds can lead to significant advancements in pharmaceuticals.

Synonyms

64236-08-4

Benzenemethanamine, 5-bromo-N,N-bis(2-chloroethyl)-2-methoxy-

5-Bromo-N,N-bis(2-chloroethyl)-2-methoxybenzenemethanamine

DTXSID70214435