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Catalog Number
ACM266349831-2
Product Name
BTB
Structure
CAS
266349-83-1
Category
Organic Light-Emitting Diode (OLED) Materials
Synonyms
4,4'-Bis(4,6-diphenyl-1,3,5-triazin-2-yl)biphenyl;4,4'-Bis(4,6-diphenyl-1,3,5-triazin-2-yl)-1,1'-biphenyl;2-[4-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]phenyl]-4,6-diphenyl-1,3,5-triazine;SCHEMBL413386
IUPAC Name
2-[4-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]phenyl]-4,6-diphenyl-1,3,5-triazine
Molecular Weight
616.7
Molecular Formula
C42H28N6
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
Purity
95%+
Density
1.219 g/ml
Complexity
808
Covalently-Bonded Unit Count
1
Exact Mass
616.237545g/mol
Formal Charge
0
Heavy Atom Count
48
Monoisotopic Mass
616.237545g/mol
Rotatable Bond Count
7
XLogP3
9.6
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