Description

Phenol, 2-[4,6-bis([1,1′-biphenyl]-4-yl)-1,3,5-triazin-2-yl]-5-[(2-ethylhexyl)oxy]- (CAS No. 204583-39-1) is a high-purity organic compound with the molecular formula C₄₁H₃₉N₃O₂. This specialized triazine derivative is designed for advanced research and industrial applications, particularly in the fields of material science and optoelectronics. Its unique molecular structure, featuring biphenyl and phenol moieties, offers exceptional thermal stability and tunable electronic properties. Ideal for use as a building block in organic semiconductors, light-emitting diodes (OLEDs), and photovoltaic materials. Available in rigorously tested batches to ensure consistency and performance for your most demanding experiments.

Properties

• CAS Number: 204583-39-1
• Complexity: 797
• IUPAC Name: 2-[4,6-bis(4-phenylphenyl)-1,3,5-triazin-2-yl]-5-(2-ethylhexoxy)phenol
• InChI: InChI=1S/C41H39N3O2/c1-3-5-12-29(4-2)28-46-36-25-26-37(38(45)27-36)41-43-39(34-21-17-32(18-22-34)30-13-8-6-9-14-30)42-40(44-41)35-23-19-33(20-24-35)31-15-10-7-11-16-31/h6-11,13-27,29,45H,3-5,12,28H2,1-2H3
• InChI Key: ZBUFTVMOMCQOFV-UHFFFAOYSA-N
• Exact Mass: 605.30422750
• Molecular Formula: C41H39N3O2
• Molecular Weight: 605.8
• SMILES: CCCCC(CC)COC1=CC(=C(C=C1)C2=NC(=NC(=N2)C3=CC=C(C=C3)C4=CC=CC=C4)C5=CC=C(C=C5)C6=CC=CC=C6)O
• Topological: 68.1
• Monoisotopic Mass: 605.30422750
• Physical Description: Other Solid
• Synonyms: 204583-39-1, Phenol, 2-[4,6-bis([1,1′-biphenyl]-4-yl)-1,3,5-triazin-2-yl]-5-[(2-ethylhexyl)oxy]-, DTXSID20889117, Phenol, 2-(4,6-bis((1,1′-biphenyl)-4-yl)-1,3,5-triazin-2-yl)-5-((2-ethylhexyl)oxy)-, 2-(4,6-Bis((1,1′-biphenyl)-4-yl)-1,3,5-triazin-2-yl)-5-((2-ethylhexyl)oxy)phenol, 2-[4,6-BIS([1,1′-BIPHENYL]-4-YL)-1,3,5-TRIAZIN-2-YL]-5-[(2-ETHYLHEXYL)OXY]PHENOL, DTXCID701028385, Phenol, 2-[4,6-bis([1,1′-biphenyl]-4-yl)-1,3,5-triazin-2-yl]-5-[(2-ethylhexyl)oxy]-(9CI), SCHEMBL493631, ZBUFTVMOMCQOFV-UHFFFAOYSA-N

This compound is primarily utilized as a key intermediate in the synthesis of high-performance organic electronic materials. Its structural properties make it suitable for applications in OLEDs, where it can enhance charge transport and emission efficiency. Researchers also employ it in the development of advanced photovoltaic systems due to its electron-accepting capabilities. Additionally, it serves as a valuable scaffold in the design of novel optoelectronic devices and sensors.

Safety and Hazards

GHS Hazard Statements

• Not Classified
• Reported as not meeting GHS hazard criteria by 109 of 109 companies. For more detailed information, please visit ECHA C&L website.

Hazard Classes and Categories

• Not Classified

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