1,3-bis(4-isopentyloxyphenyl)isothiourea

Identification

Molecular formula

C₂₆H₃₇N₃O₂S

CAS number

771573-57-6

IUPAC name

1,3-bis(4-isopentyloxyphenyl)isothiourea

State

At room temperature, 1,3-bis(4-isopentyloxyphenyl)isothiourea is in the solid state, often handled as a powder.

Melting point (Celsius)

81.00

Melting point (Kelvin)

354.15

Boiling point (Celsius)

207.00

Boiling point (Kelvin)

480.15

General information

Molecular weight

431.70g/mol

Molar mass

431.7020g/mol

Density

1.0700g/cm³

Appearence

1,3-bis(4-isopentyloxyphenyl)isothiourea is typically a solid compound, appearing as a crystalline powder. The color can vary depending on purity but is often white to off-white.

Comment on solubility

Solubility of 1,3-bis(4-isopentyloxyphenyl)isothiourea

The solubility of 1,3-bis(4-isopentyloxyphenyl)isothiourea can be intriguing due to its unique molecular structure. While specific solubility data for this compound might be limited, we can consider several factors that typically influence the solubility of isothioureas in general:

Polarity: The presence of isopentyloxy groups introduces a level of hydrophobicity, which may affect its interaction with polar solvents.
Solvent Interaction: This compound may show improved solubility in organic solvents such as ethanol and acetone, while being less soluble in water due to its bulky alkyl chains.
Temperature Effects: Like many organic compounds, solubility may increase with temperature, allowing for greater dissolution in various solvents at elevated levels.
pH Sensitivity: In certain conditions, the solubility could also be influenced by the pH of the solution, which might alter the ionization state of the compound.

As with many chemical compounds, performing solubility tests in diverse solvents and under different conditions would provide more precise data, enhancing our understanding of how 1,3-bis(4-isopentyloxyphenyl)isothiourea behaves in solution. Striking a balance between hydrophobic and hydrophilic characteristics is key to predicting solubility behavior. As a general statement, the solubility of this compound in water is likely to be low, while it may be more favorable in non-polar solvents.

Interesting facts

Interesting Facts about 1,3-bis(4-isopentyloxyphenyl)isothiourea

1,3-bis(4-isopentyloxyphenyl)isothiourea is a fascinating compound that has garnered attention in various fields of research, particularly in organic chemistry and materials science. Here are some intriguing aspects of this compound:

Unique Structure: This compound features a distinctive isothiourea functional group, which is characterized by the presence of both sulfur and nitrogen atoms, leading to interesting reactivity patterns.
Applications in Materials Science: Researchers have explored its potential applications as a building block in supramolecular chemistry, where it may serve as a ligand for metal complexes or as a component in organic materials.
Biological Activity: Compounds containing isothiourea derivatives are known for their diverse biological activities. There is ongoing research into the anti-cancer and anti-inflammatory properties of similar structures, making this compound a potential subject of pharmacological investigations.
Potential in Drug Development: The versatility in the modification of the isothiourea skeleton allows for the design of tailored compounds, offering exciting possibilities in drug development, particularly in the search for new therapeutics.
Environmental Considerations: As with many synthetic compounds, understanding their environmental impact and degradation pathways is vital. This compound's structure might influence its behavior in environmental systems.

In conclusion, 1,3-bis(4-isopentyloxyphenyl)isothiourea is more than just a chemical entity; it represents a convergence of chemistry, biology, and materials science. As research progresses, this compound may unveil new horizons in both fundamental and applied sciences.