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Iodised Iopanoic Acid

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Identification
Molecular formula
C9H9Cl2INO2
CAS number
96-83-3
IUPAC name
3-[bis(2-chloroethyl)amino]-4-propyl-benzoic acid
State
State

The compound is typically found as a solid at room temperature.

Melting point (Celsius)
151.50
Melting point (Kelvin)
424.65
Boiling point (Celsius)
327.30
Boiling point (Kelvin)
600.45
General information
Molecular weight
350.69g/mol
Molar mass
350.6860g/mol
Density
1.6377g/cm3
Appearence

This compound generally appears as a white to off-white crystalline powder.

Comment on solubility

Solubility of 3-[bis(2-chloroethyl)amino]-4-propyl-benzoic acid

3-[bis(2-chloroethyl)amino]-4-propyl-benzoic acid tends to exhibit unique solubility characteristics due to its chemical structure and the presence of polar functional groups. Understanding the solubility of this compound can be summarized through the following points:

  • Polar and Nonpolar Interactions: The presence of the amino group contributes to its solubility in polar solvents, while the hydrocarbon chains can lead to partial solubility in nonpolar environments.
  • Solvent Compatibility: Generally, the compound demonstrates significant solubility in solvents like:
    • Water
    • Dimethyl sulfoxide (DMSO)
    • Alcohols (e.g., ethanol, methanol)
  • Temperature Influence: Increased temperature often enhances solubility, allowing for greater molecular interaction with the solvent.
  • Effect of pH: The acidic nature of the benzoic acid moiety can affect solubility, making it more soluble in basic solutions through deprotonation.

Overall, the solubility behavior of 3-[bis(2-chloroethyl)amino]-4-propyl-benzoic acid indicates a complex interplay between its polar and nonpolar characteristics, solvent interactions, and environmental conditions. As with many organic compounds, *considering these factors is crucial for optimizing solubility in practical applications*.

Interesting facts

Interesting Facts about 3-[bis(2-chloroethyl)amino]-4-propyl-benzoic acid

This compound is an intriguing member of a class of organic compounds known as benzoic acids, which have been synthesized and modified for various applications. Here are some key points about 3-[bis(2-chloroethyl)amino]-4-propyl-benzoic acid:

  • Pharmaceutical Significance: This compound exhibits potential pharmaceutical applications, particularly in the field of oncology. Its structure suggests that it may function as an anticancer agent by interfering with cellular processes.
  • Chemical Structure: The presence of a benzoic acid moiety combined with a bis(2-chloroethyl)amino group signifies a unique interaction of hydrophobic and hydrophilic properties, making its behavior in biological systems particularly interesting.
  • Synthesis Insights: The synthesis typically involves multi-step procedures, highlighting the importance of careful control over reaction conditions. This emphasizes the complexity inherent in developing new compounds for therapeutic use.
  • Toxicity Considerations: Given the presence of the chlorine atoms, caution is warranted. Compounds with similar structures have been known to exhibit toxic properties, which necessitates thorough assessment and testing.
  • Potential Research Avenues: Future studies may focus on optimizing its effectiveness and minimizing toxicity, opening up pathways for designing new derivatives with improved therapeutic profiles.

In conclusion, 3-[bis(2-chloroethyl)amino]-4-propyl-benzoic acid is a compound that stands at the intersection of organic chemistry and medicinal research, highlighting the exciting potential for new discoveries in drug design and pharmacology.

Synonyms
BRN 2747842
BENZOIC ACID, 3-(BIS(2-CHLOROETHYL)AMINO)-4-PROPYL-
19143-31-8
3-(Bis(2-chloroethyl)amino)-4-propylbenzoic acid
DTXSID70172662
DTXCID7095153
RefChem:327162