4,4',4''-(1,3,5-Triazine-2,4,6-triyl)tris[benzaldehyde] - CAS 443922-06-3
Catalog:
BB057328
Product Name:
4,4',4''-(1,3,5-Triazine-2,4,6-triyl)tris[benzaldehyde]
CAS:
443922-06-3
Synonyms:
4,4',4''-(1,3,5-triazine-2,4,6-triyl)tribenzaldehyde
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BB057328
5 g
$899
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IUPAC Name: 4-[4,6-bis(4-formylphenyl)-1,3,5-triazin-2-yl]benzaldehyde
Description: 4,4',4''-(1,3,5-Triazine-2,4,6-triyl)tris[benzaldehyde] goes through condensation with 1,4-diaminobenzene to synthesize TATAE, an imine-based microporous covalent organic framework, which exhibits a good catalytic activity.
Molecular Weight: 393.39
Molecular Formula: C24H15N3O3
Canonical SMILES: C1=CC(=CC=C1C=O)C2=NC(=NC(=N2)C3=CC=C(C=C3)C=O)C4=CC=C(C=C4)C=O
InChI: InChI=1S/C24H15N3O3/c28-13-16-1-7-19(8-2-16)22-25-23(20-9-3-17(14-29)4-10-20)27-24(26-22)21-11-5-18(15-30)6-12-21/h1-15H
InChI Key: RXFWPOMAJBVGRU-UHFFFAOYSA-N
Melting Point: >275°C (dec.)
Purity: 97%
Solubility: DMF (Slightly)
Appearance: Off-White Solid
Storage: -20°C Freezer, Under inert atmosphere
References: Sadhasivam, V., et al. ChemistrySelect, 2, 1063-1070 (2017).
Precautionary Statement: P261-P280-P301+P312-P302+P352-P305+P351+P338
Signal Word: Warning
Complexity: 483
Compound Is Canonicalized: Yes
Covalently-Bonded Unit Count: 1
Defined Atom Stereocenter Count: 0
Defined Bond Stereocenter Count: 0
Exact Mass: 393.11134135
Formal Charge: 0
Heavy Atom Count: 30
Hydrogen Bond Acceptor Count: 6
Hydrogen Bond Donor Count: 0
Isotope Atom Count: 0
Monoisotopic Mass: 393.11134135
Rotatable Bond Count: 6
Topological Polar Surface Area: 89.9Ų
Undefined Atom Stereocenter Count: 0
Undefined Bond Stereocenter Count: 0
XLogP3: 3.3
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