61414-16-2 | 4,4',4''-(1,3,5-Triazine-2,4,6-triyl)tribenzoic acid

Packsize	Purity	Availability	Price	Discounted Price
250mg	95%	in stock	$20.00	$14.00
1g	95%	in stock	$28.00	$20.00
5g	95%	in stock	$111.00	$78.00
10g	95%	in stock	$221.00	$155.00
25g	95%	in stock	$490.00	$343.00
100g	95%	in stock	$1,511.00	$1,058.00

Description

• Catalog Number: AG70169
• Chemical Name: 4,4',4''-(1,3,5-Triazine-2,4,6-triyl)tribenzoic acid
• CAS Number: 61414-16-2
• Molecular Formula: C24H15N3O6
• Molecular Weight: 441.3924
• MDL Number: MFCD04116314
• SMILES: OC(=O)c1ccc(cc1)c1nc(nc(n1)c1ccc(cc1)C(=O)O)c1ccc(cc1)C(=O)O

Computed Properties

• Complexity: 602
• Covalently-Bonded Unit Count: 1
• Heavy Atom Count: 33
• Hydrogen Bond Acceptor Count: 9
• Hydrogen Bond Donor Count: 3
• Rotatable Bond Count: 6
• XLogP3: 3.5

Upstream Synthesis Route

2,4,6-Tris(4-Carboxyphenyl)-1,3,5-Triazine, often referred to as TCPT, is a versatile compound widely used in chemical synthesis. One of its key applications lies in its utility as a building block for creating functional materials. When incorporated into various synthetic processes, TCPT serves as a core component in the fabrication of polymers, resins, and coordination complexes.In chemical synthesis, TCPT acts as a linking agent due to its multiple carboxylic acid groups, which provide binding sites for further chemical reactions. By leveraging the unique structure of TCPT, chemists are able to craft intricate molecular frameworks with tailored properties. This compound plays a crucial role in the design and development of novel materials with applications spanning from pharmaceuticals to advanced engineering.Moreover, the presence of the triazine ring in TCPT enhances its stability and chemical reactivity, making it a valuable building block in the construction of complex molecular architectures. Through precise manipulation of TCPT in chemical synthesis, researchers can achieve targeted modifications and functionalizations, leading to the creation of custom-designed materials with specific chemical and physical characteristics.

Literature

• Further investigation of the effect of framework catenation on hydrogen uptake in metal-organic frameworks.

  Journal of the American Chemical Society 20081126