117100-41-1

Basic information

• Product Name: 1,3,5-tris[(4-methoxycarbonyl)phenyl]benzene
• Synonyms: 1,3,5-tris[(4-methoxycarbonyl)phenyl]benzene
• CAS NO: 117100-41-1
• Molecular Formula: C₃₀H₂₄O₆
• Molecular Weight: 480.50796
• Mol File: 117100-41-1.mol

Chemical Properties

• Appearance: /
• CAS DataBase Reference: 1,3,5-tris[(4-methoxycarbonyl)phenyl]benzene(CAS DataBase Reference)
• NIST Chemistry Reference: 1,3,5-tris[(4-methoxycarbonyl)phenyl]benzene(117100-41-1)
• EPA Substance Registry System: 1,3,5-tris[(4-methoxycarbonyl)phenyl]benzene(117100-41-1)

Safety Data

• Hazardous Substances Data: 117100-41-1(Hazardous Substances Data)

Usage

Uses

Used in Organic Synthesis:
1,3,5-tris[(4-methoxycarbonyl)phenyl]benzene is utilized as a building block in organic synthesis for the creation of various complex organic molecules. Its unique structure and functional groups facilitate the formation of new chemical bonds and the synthesis of a wide range of compounds.
Used in Materials Science:
In the field of materials science, 1,3,5-tris[(4-methoxycarbonyl)phenyl]benzene is employed as a precursor for the development of advanced materials. Its properties make it suitable for use in the production of organic semiconductors and light-emitting materials, which are crucial for applications in electronic devices and optoelectronics.
Used in Pharmaceutical Industry:
1,3,5-tris[(4-methoxycarbonyl)phenyl]benzene is used as a key intermediate in the synthesis of pharmaceutical compounds. Its unique structure allows for the development of new drugs with potential therapeutic applications.
Used in Chemical Research:
1,3,5-tris[(4-methoxycarbonyl)phenyl]benzene is also used in chemical research as a model system to study the properties and behavior of organic molecules. It aids researchers in understanding the fundamental principles of organic chemistry and contributes to the advancement of the field.

Upstream product

• 3609-53-8 methyl 4-acetylbenzoate 
• 626-39-1 1,3,5-trisbromobenzene 
• 99768-12-4 4-methoxycarbonylphenylboronic acid 

Downstream Products

• 50446-44-1 1,3,5,-tris(4-carboxyphenyl)benzene 
• 353289-47-1 1,3,5-tris[(4-hydroxymethyl)phenyl]benzene 

Relevant articles and documents

Synthesis of C3-symmetric tri(alkylamino) guests and their interaction with cyclodextrins

The synthesis of a series of star-shaped C3-symmetric amines and their inclusion complexation properties toward α-, β-, γ-cyclodextrins and their permethylated derivatives has been described. The star molecules comprise of 1, 3, 5-trisubstited benzene core and the points formed by (alkylamino)methyl or 4-((alkylamino)methyl)phenyl groups. The modes of host-guest interaction were studied by UV-Vis spectroscopy, ITC, 1H NMR and 2D-NMR (NOESY). It was found that star molecules containing (tert-butylamino)methyl, (adamantan-1-ylamino)methyl, 4-((isopropylamino)methyl) phenyl, 4-((tert-butylamino)methyl)phenyl and protonated 4-((adamantan-1-ylamino)methyl)phenyl points form strong host-guest complexes with β-cyclodextrin. It was also proved that the largest C3-symmetric guest can form complexes with bcyclodextrin with stoichiometry 3 which is required for construction of dendrimer supramolecular structures. None of the investigated amines forms a strong complex with permethylated cyclodextrins.

Novel C3-symmetrical triphenylbenzene-based organogelators with different linkers between phenyl ring and alkyl chain

A new family of 1,3,5-triphenylbenzene-based organogelators with approximately identical side chain length have been synthesized and fully characterized. The molecular aggregation can be promoted by hydrogen-bonding and van der Waals interaction. The magnitudes of hydrogen bonding interactions between the linkers on the triphenylbenzene cores are qualitatively in the order of -CONHNHCO-, -NHCONH->-NHCO->-CONH->-NHCSNH-, consequently resulting in different gelation behaviors. The sol-gel transitions of gels 3 and 4 in toluene are thermodynamically reversible, while the formations of gels 2 and 5 in dioxane are kinetically controlled. The urea-based gel 2 can selectively recognize F- ion.

Synthesis of 3,5-Disubstituted Isoxazoles through a 1,3-Dipolar Cycloaddition Reaction between Alkynes and Nitrile Oxides Generated from O-Silylated Hydroxamic Acids

In this paper, we report the regioselective synthesis of 3,5-disubstituted isoxazoles by 1,3-dipolar cycloaddition between alkynyl dipolarophiles and nitrile oxide dipoles generated in-situ from O-silylated hydroxamic acids in the presence of trifluoromethanesulfonic anhydride and NEt3. Thanks to the mild, metal-free and oxidant-free conditions that this strategy offers, the reaction was successfully applied to a wide variety of alkynyl dipolarophiles, demonstrating the tolerance of this approach to diverse functional groups. In particular, we have shown that the method was compatible with biological molecules such as peptides and peptide nucleic acids (PNA). This protocol constitutes another example of metal-free 1,3-dipolar cycloaddition leading to the regioselective formation of isoxazoles.

Monocrystalline iron metal organic frameworks

The invention relates to large single crystals of iron metal-organic framework materials comprising at least one iron metal ion, processes for preparing the same, methods for employing the same, and the use thereof. The invention also relates to monocrystalline and polycrystalline iron metal-organic frameworks.

Chromium Metal Organic Frameworks and Synthesis of Metal Organic Frameworks

The present invention relates to monocrystalline metal organic frameworks comprising chromium ions and carboxylate ligands and the use of the same, for example their use for storing a gas. The invention also relates to methods for preparing metal organic frameworks comprising chromium, titanium or iron ions and carboxylate ligands. The methods of the invention allow such metal organic frameworks to be prepared in monocrystalline or polycrystalline forms.

Aluminum Metal Organic Framework Materials

The invention relates to monocrystalline single crystals of metal-organic framework materials comprising at least one aluminium metal ion, processes for preparing the same, methods for employing the same, and the use thereof. The invention also relates to monocrystalline aluminium metal-organic frameworks.