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Merck
CN

741175

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
NACRES:
NA.23
PubChem Substance ID:
329765471
UNSPSC Code:
26111700
MDL number:
MFCD04116314

Key Documents

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Product Name

4,4′,4″-s-Triazine-2,4,6-triyl-tribenzoic acid, 95%

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)

SMILES string

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

InChI key

MSFXUHUYNSYIDR-UHFFFAOYSA-N

assay

95%

form

solid

greener alternative product characteristics

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sustainability

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mp

83-88 °C

greener alternative category

, Enabling

Quality Level

100

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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.

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.

pictograms

Exclamation mark
GHS07

signalword

Warning

Hazard Classifications

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

target_organs

Respiratory system

Storage Class

11 - Combustible Solids

wgk

WGK 3

flash_point_f

Not applicable

flash_point_c

Not applicable

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Certificates of Analysis (COA)

Lot/Batch Number
MKCL8242
MKCK6651
MKCH6957
MKCF3063
MKCC6466

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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.
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
A 3D heterometallic Pb(II)-Na(I) coordination polymer as a sensitive and selective fluorescent sensor for detecting Fe3 +
Ming M and Bai N
Inorganic Chemistry Communications, 75, 37-40 (2017)
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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