Description

1,3,5-Tris(3-bromophenyl)benzene (CAS No. 96761-85-2) is a high-purity brominated aromatic compound with the molecular formula C₂₄H₁₅Br₃. This trifunctionalized benzene derivative is characterized by its three symmetrically substituted 3-bromophenyl groups, making it a valuable building block in organic synthesis and materials science. With a molecular weight of 534.09 g/mol, this white to off-white crystalline solid exhibits excellent thermal stability and is soluble in common organic solvents such as THF, DCM, and toluene. Ideal for researchers in supramolecular chemistry, polymer science, and optoelectronics, our product is rigorously tested to ensure ≥95% purity (HPLC) and is supplied with comprehensive analytical data including ¹H NMR, ¹³C NMR, and mass spectrometry. Packaged under inert atmosphere to prevent degradation, this compound is particularly useful for constructing star-shaped molecular architectures and as a precursor for Suzuki coupling reactions.

Properties

• CAS Number: 96761-85-2
• Complexity: 388
• IUPAC Name: 1,3,5-tris(3-bromophenyl)benzene
• InChI: InChI=1S/C24H15Br3/c25-22-7-1-4-16(13-22)19-10-20(17-5-2-8-23(26)14-17)12-21(11-19)18-6-3-9-24(27)15-18/h1-15H
• InChI Key: JKCQADHKVQXKFF-UHFFFAOYSA-N
• Exact Mass: 541.87034
• Molecular Formula: C24H15Br3
• Molecular Weight: 543.1
• SMILES: C1=CC(=CC(=C1)Br)C2=CC(=CC(=C2)C3=CC(=CC=C3)Br)C4=CC(=CC=C4)Br
• Monoisotopic Mass: 539.87239
• Synonyms: 1,3,5-Tris(3-bromophenyl)benzene, 96761-85-2, 3,3”-Dibromo-5′-(3-bromophenyl)-1,1′:3′,1”-terphenyl, MFCD02323390, YSWG021, SCHEMBL1345303, DTXSID10404439, AKOS005146176, AC-7651, DS-17420, SY055288, CS-0110814, T3073, AC-776/15493005, 3′,3”,3”’-tribromo-1,1′:3,1”:5,1”’-quaterphenyl, 3,3 inverted exclamation mark inverted exclamation mark -Dibromo-5 inverted exclamation mark -(3-bromophenyl)-1,1 inverted exclamation mark :3 inverted exclamation mark ,1 inverted exclamation mark inverted exclamation mark -terphenyl

Application

1,3,5-Tris(3-bromophenyl)benzene serves as a crucial trifunctionalized core for designing dendrimers and star-shaped conjugated molecules in organic electronics. The compound’s three reactive bromine sites enable efficient cross-coupling reactions for constructing porous organic polymers (POPs) with tunable porosity for gas storage applications. Researchers utilize this building block to develop advanced materials for organic light-emitting diodes (OLEDs) due to its rigid triphenylbenzene scaffold that enhances thermal and morphological stability. In supramolecular chemistry, it acts as a key precursor for synthesizing shape-persistent macrocycles with precisely controlled cavity sizes.

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