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741175

Sigma-Aldrich

4,4′,4″-s-Triazine-2,4,6-triyl-tribenzoic acid

greener alternative

95%

Synonym(s):

2,4,6-Tris(4-carboxyphenyl)-s-triazine, 4,4′,4″-[1,3,5]Triazine-2,4,6-triyl-tris-benzoic acid, p-Cyanobenzoic acid trimer, H3TATB

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About This Item

Empirical Formula (Hill Notation):
C24H15N3O6
CAS Number:
61414-16-2
Molecular Weight:
441.39
MDL number:
MFCD04116314
UNSPSC Code:
26111700
PubChem Substance ID:
329765471
NACRES:
NA.23

Assay

95%

form

solid

greener alternative product characteristics

Design for Energy Efficiency
Learn more about the Principles of Green Chemistry.

sustainability

Greener Alternative Product

mp

83-88 °C

greener alternative category

, Enabling

SMILES string

OC(=O)c1ccc(cc1)-c2nc(nc(n2)-c3ccc(cc3)C(O)=O)-c4ccc(cc4)C(O)=O

InChI

1S/C24H15N3O6/c28-22(29)16-7-1-13(2-8-16)19-25-20(14-3-9-17(10-4-14)23(30)31)27-21(26-19)15-5-11-18(12-6-15)24(32)33/h1-12H,(H,28,29)(H,30,31)(H,32,33)

InChI key

MSFXUHUYNSYIDR-UHFFFAOYSA-N

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General description

We are committed to bringing you Greener Alternative Products, which adhere to one or more of The 12 Principles of Greener Chemistry. This product has been enhanced for energy efficiency. Find details here.

Application

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.

Pictograms

Exclamation mark
GHS07

Signal Word

Warning

Hazard Statements

H315,H319,H335

Hazard Classifications

Eye Irrit. 2 - Skin Irrit. 2 - STOT SE 3

Target Organs

Respiratory system

Storage Class Code

11 - Combustible Solids

WGK

WGK 3

Flash Point(F)

Not applicable

Flash Point(C)

Not applicable

Certificates of Analysis (COA)

Search for Certificates of Analysis (COA) by entering the products Lot/Batch Number. Lot and Batch Numbers can be found on a product’s label following the words ‘Lot’ or ‘Batch’.

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Framework-catenation isomerism in metal-organic frameworks and its impact on hydrogen uptake.
Shengqian Ma et al.
Journal of the American Chemical Society, 129(7), 1858-1859 (2007-01-30)
Shengqian Ma et al.
Inorganic chemistry, 48(5), 2072-2077 (2009-02-25)
Under solvothermal conditions, the reactions of trigonal-planar ligand, TATB (4,4',4''-s-triazine-2,4,6-triyl-tribenzoate) with Dy(NO(3))(3), Er(NO(3))(3), Y(NO(3))(3), Yb(NO(3))(3), gave rise to four microporous lanthanide metal-organic frameworks (MOFs), designated as PCN-17 (Dy), PCN-17 (Er), PCN-17 (Y), and PCN-17 (Yb), respectively. The four porous MOFs
Shengqian Ma et al.
Journal of the American Chemical Society, 128(36), 11734-11735 (2006-09-07)
A metal-organic framework, PCN-9, containing entatic metal centers, has been synthesized and crystallographically characterized. The H2 and CH4 adsorption enthalpies of PCN-9 are among the highest reported thus far.
Electrochromic 2, 4, 6-triphenyl-1, 3, 5-triazine based esters with electron donor-acceptor structure
Zhang W, et al.
Organic Electronics, 67, 302-310 (2019)
Control of catenation in CuTATB-n metal-organic frameworks by sonochemical synthesis and its effect on CO 2 adsorption
Kim J, et al.
Journal of Materials Chemistry, 21(9), 3070-3076 (2011)
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