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Identification
Molecular formula
C12H12INO3
CAS number
146533-29-3
IUPAC name
4-iodobut-2-ynyl N-(4-methoxyphenyl)carbamate
State
State

Under standard conditions, this compound is typically found in a solid state. Its solid form is a result of the compound's relatively large molar mass and complex structure, which contributes to stronger intermolecular forces that keep it in a solid state at room temperature.

Melting point (Celsius)
141.00
Melting point (Kelvin)
414.15
Boiling point (Celsius)
312.50
Boiling point (Kelvin)
585.65
General information
Molecular weight
331.13g/mol
Molar mass
331.1120g/mol
Density
1.5940g/cm3
Appearence

4-Iodobut-2-ynyl N-(4-methoxyphenyl)carbamate appears as a solid compound, commonly in a crystalline form. Its appearance can vary slightly depending on purity and other conditions, but it typically presents as a fine, off-white to light yellow powder.

Comment on solubility

Solubility of 4-iodobut-2-ynyl N-(4-methoxyphenyl)carbamate

The solubility of 4-iodobut-2-ynyl N-(4-methoxyphenyl)carbamate is influenced by several factors including the molecular structure, polarity, and the presence of functional groups. Generally, carbamates tend to have varied solubility in different solvents.

Here are some key points regarding the solubility characteristics of this compound:

  • Polar vs. Nonpolar Solvents: The presence of the carbamate group indicates potential solubility in polar solvents such as water and ethanol, while the hydrophobic nature of the butynyl and methoxyphenyl groups may limit solubility in purely polar environments.
  • Influence of Halogen: The iodine atom in the 4-iodobut-2-ynyl part can affect the overall polarity and thus the solubility profile, making it more soluble in nonpolar organic solvents.
  • Temperature Dependence: As with many organic compounds, solubility can increase with temperature, suggesting that heating the solvent may aid in dissolving the compound more effectively.

In summary, while 4-iodobut-2-ynyl N-(4-methoxyphenyl)carbamate may display some level of solubility in polar solvents due to the carbamate moiety, its overall solubility characteristics are likely to be complex and should be evaluated based on specific experimental conditions. Trial and error with different solvents could yield the best results for solubility testing.

Interesting facts

Interesting Facts about 4-iodobut-2-ynyl N-(4-methoxyphenyl)carbamate

4-iodobut-2-ynyl N-(4-methoxyphenyl)carbamate is a fascinating compound that exists at the intersection of organic chemistry and medicinal research. Here are some compelling aspects regarding this unique molecule:

  • Structural Framework: The compound features a complex structure that includes an iodine atom, a triple bond, and a carbamate functional group. This intricate combination of elements enhances its reactivity and potential applications in organic synthesis.
  • Biological Significance: Carbamate derivatives, including this one, are often investigated for their biological properties. They can serve as inhibitors or modulators in various biochemical pathways, making them valuable in drug discovery and development.
  • Versatile Synthesis: The synthesis of such compounds often involves creative methodologies, including cross-coupling reactions and nucleophilic substitutions, which reflect the versatility and ingenuity of modern synthetic chemistry.
  • Potential Applications: Given its structure, 4-iodobut-2-ynyl N-(4-methoxyphenyl)carbamate may hold promise in the fields of agriculture (as a pesticide) or medicine, particularly in targeting specific pathways for therapeutic effect.
  • Research Opportunities: Scientists continue to explore the potential of similar carbamate-based compounds, focusing on their activity against various targets, which opens up possibilities for innovative solutions to combat diseases.

In summary, 4-iodobut-2-ynyl N-(4-methoxyphenyl)carbamate exemplifies the complexity and diversity of chemical compounds that not only challenge chemists in terms of synthesis but also inspire them to explore their therapeutic potential. As we continue to unlock the secrets of such molecules, the future of medicinal chemistry becomes ever more exciting!

Synonyms
14313-51-0
BRN 2740705
4-Iodo-2-butynyl p-methoxycarbanilate
CARBANILIC ACID, p-METHOXY-, 4-IODO-2-BUTYNYL ESTER
p-Methoxycarbanilic acid 4-iodo-2-butynyl ester
DTXSID90162323
DTXCID4084814
4-iodobut-2-ynyl N-(4-methoxyphenyl)carbamate
4-Methoxyphenylcarbamic acid 4-iodo-2-butynyl ester