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6-[Difluoro(phosphono)methyl]naphthalene-2-carboxylic acid

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Identification
Molecular formula
C12H7F2O5P
CAS number
,916069-16-0
IUPAC name
6-[difluoro(phosphono)methyl]naphthalene-2-carboxylic acid
State
State

The compound is in a solid state at room temperature. It is stable under normal conditions but should be handled with care as it may decompose upon exposure to strong bases or acids.

Melting point (Celsius)
110.00
Melting point (Kelvin)
383.15
Boiling point (Celsius)
200.00
Boiling point (Kelvin)
473.15
General information
Molecular weight
288.17g/mol
Molar mass
288.1740g/mol
Density
1.5400g/cm3
Appearence

The compound is typically a white crystalline solid. The crystals form in elongated or prismatic shapes and are often highly luminescent under ultraviolet light. It may appear slightly yellowish depending on purity.

Comment on solubility

Solubility of 6-[difluoro(phosphono)methyl]naphthalene-2-carboxylic acid

The solubility of 6-[difluoro(phosphono)methyl]naphthalene-2-carboxylic acid (C12H7F2O5P) is influenced by several factors that relate to its unique chemical structure. This compound features a naphthalene backbone, which is generally hydrophobic, while the presence of phosphonic acid functional groups introduces polarity and potential for hydrogen bonding.

Here's a breakdown of its solubility characteristics:

  • Hydrophobic interactions: The naphthalene moiety decreases its overall solubility in water.
  • Hydrophilic groups: The phosphonic acid group enhances solubility in polar solvents due to its ability to ionize and interact with water molecules.
  • Fluorine atoms: The presence of difluoro substituents may increase the compound's ability to engage in Lewis acid-base interactions, potentially affecting solubility in various organic solvents.

In summary, while the overall structure suggests moderate solubility in polar solvents, it is likely that solubility characteristics may be further influenced by the specific solvent used, temperature, and concentration. It is critical to approach such compounds with experimental data for accurate solubility profiling, as theoretical predictions may not fully capture the complexities involved.

Interesting facts

Interesting Facts about 6-[Difluoro(phosphono)methyl]naphthalene-2-carboxylic Acid

6-[Difluoro(phosphono)methyl]naphthalene-2-carboxylic acid is a fascinating chemical compound that holds promise in various fields, particularly in organic chemistry and material sciences. Here are some intriguing aspects of this compound:

  • Fluorinated Aromatic Compound: The presence of fluorine atoms in its structure enhances the chemical's stability and alters its reactivity, making it an interesting candidate for pharmaceutical development.
  • Role of Phosphono Group: The phosphono functional group can significantly influence biological activity, making this compound relevant in the synthesis of bioactive molecules.
  • Potential Applications: Due to its unique structure, it may be useful in agrochemicals, photovoltaics, and even in the creation of new materials.
  • Analytical Techniques: The study of such compounds often requires advanced analytical techniques such as Nuclear Magnetic Resonance (NMR) and Mass Spectrometry (MS) for structural elucidation.

As a compound with both aromatic and phosphonic features, it presents a unique opportunity for chemists to explore functionalization pathways. The integration of fluorine not only helps improve certain properties but also allows researchers to investigate potential selective reactivity in synthetic pathways. It's a clear reminder of how small modifications in molecular architecture can lead to diverse and impactful chemical behaviors.

In conclusion, the study of 6-[difluoro(phosphono)methyl]naphthalene-2-carboxylic acid showcases the importance of interdisciplinary approaches in chemistry, merging principles from organic chemistry, materials science, and bioactivity research.

Synonyms
6-(difluoro-phosphono-methyl)-naphthalene-2-carboxylic acid
6-[difluoro(phosphono)methyl]naphthalene-2-carboxylic acid
CHEMBL99447
6-(difluoro(phosphono)methyl)naphthalene-2-carboxylic acid
1bzj
6-(phosphonodifluoromethyl)-2-naphthoic acid
SCHEMBL4593335
NKGNOWNPXBURRW-UHFFFAOYSA-N
BDBM50103227
DB08397
PD004437
NS00068904
Q27097609