2-(3-Bromophenyl)-4,6-diphenyl-1,3,5-triazine

Name: 2-(3-Bromophenyl)-4,6-diphenyl-1,3,5-triazine
Brand: ChemScene
Availability: InStock
Rating: 5 (1 reviews)

CAS No. 864377-31-1
Cat. No. CS-W023167
Purity≥97%
MDL No.MFCD22200060

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Type	HazMat Fee
Excepted Quantity	$0.00
FedEx Limited Quantities Ground	$0.00
Hazmat Ground shipping	$50.00+
Inaccessible (Haz class 6.1 or 9), Domestic	$68.00+
Accessible (Haz class 3, 4, 5 or 8), Domestic	$158.00+
Inaccessible (Haz class 6.1 or 9), International	$108.00+
Accessible (Haz class 3, 4, 5 or 8), International	$238.00+

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2-(3-Bromophenyl)-4,6-diphenyl-1,3,5-triazine|CS-W023167

Structure of 864377-31-1

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General Information

CAS No. 864377-31-1
Cat. No. CS-W023167
Purity ≥97%
MDL No. MFCD22200060
Storage Store at room temperature
Shipping Room temperature in continental US; may vary elsewhere.
Molecular Formula C₂₁H₁₄BrN₃
Molecular Weight 388.26
Synonym(s) TIANFU-CHEM 2-(3-Bromophenyl)-4,6-diphenyl-1,3,5-triazine
SMILES BrC1=CC(C2=NC(C3=CC=CC=C3)=NC(C4=CC=CC=C4)=N2)=CC=C1

Description

This triazine derivative features a 3-bromophenyl group flanked by two phenyl substituents at the 4- and 6-positions, creating a sterically crowded, electron-deficient core. The bromine atom enables direct functionalization in cross-coupling reactions, while the extended aromatic system enhances stability and facilitates π-stacking interactions in materials applications.

Application

2-(3-Bromophenyl)-4,6-diphenyl-1,3,5-triazine serves as a versatile building block in cross-coupling chemistry, enabling palladium-catalyzed transformations to access biaryl-substituted triazine scaffolds. The bromo group facilitates reliable coupling with arylboranes and heteroaryl halides under standard conditions, while the triazine core provides structural rigidity and tunable electronic properties. Bench-stable and readily purified by column chromatography, it supports efficient synthesis of functionalized heterocycles relevant to pharmaceutical and materials research.

Synthesis

Route1
- 18467-14-6
- In-stock
  
  1670-14-0
- ~35%
- In-stock
  
  864377-31-1
References
- Idemitsu Kosan Co., Ltd. Patent: EP2415769 A1, 2012 ; Location in patent: Page/Page column 118-119 ;
Route2
- In-stock
  
  3132-99-8
- ~%
- In-stock
  
  864377-31-1
References
- EP2415769 A1, ;

Safety Information

Download SDS

GHS Pictogram :	GHS No : GHS07
Signal Word : Warning	UN#: N/A
Class : N/A	Packing Group : N/A
Hazard Statements : H302-H315-H319-H335
Precautionary Statements : P261-P264-P270-P271-P280-P302+P352-P304+P340-P305+P351+P338-P330-P362+P364-P403+P233-P405-P501

Quality Control

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Computational Chemistry Data

TPSA 38.67
LogP 5.6351
H_Acceptors 3
H_Donors 0
Rotatable_Bonds 3

Other Classifications

Material Science Material Composite Block Small Molecule Semiconductor Synthesis Building Block

Building Blocks Functional Group Bromide

Building Blocks Skeleton Aromatic heterocycle compounds Triazine compounds

Building Blocks Skeleton Aromatic ring compounds Benzene compounds

Material Science Material Building Blocks Small Molecule Semiconductor Building Blocks Triazines

Key Words

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2-(3-Bromophenyl)-4,6-diphenyl-1,3,5-triazine

CAS No. 864377-31-1

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