61414-16-2

Basic information

• Product Name: 2,4,6-TRIS(4-CARBOXYPHENYL)-1,3,5-TRIAZINE
• Synonyms: 2,4,6-TRIS(4-CARBOXYPHENYL)-1,3,5-TRIAZINE;2,4,6-Tris(carboxyphenyl)-1,3,5-triazine;2,4,6-Tri(4-carboxyphenyl)-1,3,5-triazine;2,5-Di(4-carboxyphenyl)thiophene;4,4',4''-(1,3,5-triazine-2,4,6-triyl)tribenzoic acid;2,4,6-Tris(4-carboxyphenyl)-s-triazine;4,4μ,4-s-Triazine-2,4,6-triyl-tribenzoic acid;4,4μ4-[1,3,5]Triazine-2,4,6-triyl-tris-benzoic acid
• CAS NO: 61414-16-2
• Molecular Formula: C₂₄H₁₅N₃O₆
• Molecular Weight: 441.39
• Product Categories: pharmacetical;Alternative Energy;Materials for Hydrogen Storage;Materials Science;Metal Organic Frameworks (MOFs);Organic Linker Molecules;Physisorption
• Mol File: 61414-16-2.mol
• Article Data: 17

Chemical Properties

• Melting Point: 83-88℃
• Boiling Point: 799.9±70.0 °C(Predicted)
• Appearance: /
• Density: 1.458±0.06 g/cm3(Predicted)
• Storage Temp.: Sealed in dry,Room Temperature
• Solubility: Aqueous Base (Slightly), DMSO (Slightly, Heated)
• PKA: 3.27±0.10(Predicted)
• CAS DataBase Reference: 2,4,6-TRIS(4-CARBOXYPHENYL)-1,3,5-TRIAZINE(CAS DataBase Reference)
• NIST Chemistry Reference: 2,4,6-TRIS(4-CARBOXYPHENYL)-1,3,5-TRIAZINE(61414-16-2)
• EPA Substance Registry System: 2,4,6-TRIS(4-CARBOXYPHENYL)-1,3,5-TRIAZINE(61414-16-2)

Safety Data

• Hazard Codes: T
• Statements: 61-20/21-36/37/38-50/53-36/38
• Safety Statements: 53-26-36/37-45-61
• WGK Germany: 3
• Hazardous Substances Data: 61414-16-2(Hazardous Substances Data)

Usage

Uses

4,4′,4′′-s-Triazine-2,4,6-triyl-tribenzoic acid (H3TATB) is an electron acceptor that can be used in the synthesis of an electrochromic material (ECM). ECM can be used for a variety of applications such as electronic paper, smart windows, and energy storage devices. It can also be used in the formation of a metal-organic framework (MOF) for potential usage in CO2 adsorption. It can be used in the preparation of PCN-333(Al) based MOFs for the fabrication of an electrochemical biosensor.

General Description

This product has been enhanced for energy efficiency.

Upstream product

• 6726-45-0 2,4,6-tris(p-tolyl)-1,3,5-triazine 

Relevant articles and documents

Two New Solvent-modulated Zinc(II) Metal-Organic Hybrid Materials based on Rigid Tripodal Carboxylate Ligand and 2,2′-Bipy Co-ligand: Crystal Structures and Luminescent Properties

The zinc(II) coordination polymers [Zn(Htatb)(2,2′-bipy)·(NMP)·H2O] (1) and [Zn3(tatb)2(2,2′-bipy)3·H2O] (2) (H3tatb = 4,4′,4′′-s-triazine-2,4,6-triyl-tribenzoic acid; 2,2′-bipy = 2,2′-bipyridyl, NMP = N-methyl-2-pyrrolidon), were synthesized hydrothermally, and characterized by infrared spectroscopy (IR), powder X-ray diffraction (PXRD), and single-crystal X-ray diffraction. Both compounds 1 and 2 possess expectant low dimensional coordination structures, which further connected into interesting 3D networks by hydrogen bond and strong π-π interactions. Moreover, the thermal stabilities and fluorescent properties of 1 and 2 were investigated.

Synthesis, characterization, and photoluminescence of isostructural Mn, Co, and Zn MOFs having a diamondoid structure with large tetrahedral cages and high thermal stability

Three novel Mn, Co, and Zn MOFs containing large tetrahedral cages have been prepared and are stable up to 400 °C; X-ray diffraction revealed the frameworks are isostructural having a diamondoid structure of "hourglass" subunits connected by triangular carboxylate ligands. The Royal Society of Chemistry 2005.

An interweaving MOF with high hydrogen uptake

An interweaving copper metal-organic framework possessing high porosity and high hydrogen uptake has been successfully designed and synthesized. Copyright

Two novel 3D-MOFs (Ca-TATB and Co-HKUST): Synthesis, structure and characterization

We report X-ray crystallographic investigations of two novel metal–organic frameworks (MOFs) by using 4,4′,4′'-s-triazine-2,4,6-triyltribenzoic acid [H3TATB] ligand with Ca metal for 1 and 1,3,5 benzene tri-carboxylic acid [H3BTC] ligand with Co metal for 2 respectively. The compound [Ca6(TATB)4(H2O)(DMA)4] (1); (where DMA = dimethylacetamide); was successfully synthesized in a sealed tube at 110 °C for 72 h and shows the formation of a 3D network with embedded 1D channels which are occupied by solvent molecules. The structure of the compound 1 is relatively new and its structural differences with the reported Cu-TATB compounds are noteworthy. The compound Co-HKUST (2) was synthesized by solvothermal method at 140 °C for 72 h. Paddlewheel secondary building units are used to construct Co-HKUST (2) which is isostructural analogue of HKUST-1 enriching the series which consists of Cr, Fe, Ni, Zn, Mo, and Ru analogues. Both 1 and 2 are metastable MOFs characterized by complementary techniques namely powder X-ray diffraction and FTIR analysis.

Tuning the Structure and Hydrolysis Stability of Calcium Metal-Organic Frameworks through Integrating Carboxylic/Phosphinic/Phosphonic Groups in Building Blocks

Crystal structure and hydrolysis stability are fundamentally important for the application of metal-organic frameworks (MOFs) in biotechnology. Herein, five novel 3-D MOFs, built up from biocompatible calcium ions and ligands containing carboxylic, phosphinic, or phosphonic coordinating groups, have been solvothermally synthesized, and their crystal structures were determined by single-crystal X-ray diffraction. Their hydrolysis stability study demonstrated that the water stability of these Ca-based MOFs can be tuned by integrating carboxylic/phosphinic/phosphonic coordinating groups in building blocks.