BTB

• CAS: 266349-83-1
• Catalog Number: ACM266349831
• Category: Organic Light Emitting Diode (OLED)
• Molecular Weight: 616.71 g/mol
• Molecular Formula: C42H28N6
• Synonyms: 4,4'-Bis(4,6-diphenyl-1,3,5-triazin-2-yl)biphenyl
• IUPAC Name: 2-[4-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]phenyl]-4,6-diphenyl-1,3,5-triazine
• Canonical SMILES: C1=CC=C(C=C1)C2=NC(=NC(=N2)C3=CC=C(C=C3)C4=CC=C(C=C4)C5=NC(=NC(=N5)C6=CC=CC=C6)C7=CC=CC=C7)C8=CC=CC=C8
• InChI: InChI=1S/C42H28N6/c1-5-13-31(14-6-1)37-43-38(32-15-7-2-8-16-32)46-41(45-37)35-25-21-29(22-26-35)30-23-27-36(28-24-30)42-47-39(33-17-9-3-10-18-33)44-40(48-42)34-19-11-4-12-20-34/h1-28H
• InChI Key: UICMBMCOVLMLIE-UHFFFAOYSA-N
• Boiling Point: 362 °C
• Melting Point: 878.2 ± 75.0 °C
• Density: 1.219 g/ml
• Complexity: 808
• Covalently-Bonded Unit Count: 1
• Exact Mass: 616.237545g/mol
• Formal Charge: 0
• Grade: Sublimed >99% / Unsublimed >98%
• H-Bond Acceptor: 6
• H-Bond Donor: 0
• Heavy Atom Count: 48
• Monoisotopic Mass: 616.237545g/mol
• Rotatable Bond Count: 7
• TGA: >360 ℃ (0.5% weight loss)
• XLogP3: 9.6