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4,4',4''-Tris(carbazol-9-yl)-triphenylamine

Catalog Number
ACM139092787-4
CAS Number
139092-78-7
Product Name
4,4',4''-Tris(carbazol-9-yl)-triphenylamine
Structure
Category
Organic Light-Emitting Diode (OLED) Materials
IUPAC Name
4-carbazol-9-yl-N,N-bis(4-carbazol-9-ylphenyl)aniline
Molecular Weight
740.9g/mol
Molecular Formula
C54H36N4
Canonical SMILES
C1=CC=C2C(=C1)C3=CC=CC=C3N2C4=CC=C(C=C4)N(C5=CC=C(C=C5)N6C7=CC=CC=C7C8=CC=CC=C86)C9=CC=C(C=C9)N1C2=CC=CC=C2C2=CC=CC=C21
InChI
InChI=1S/C54H36N4/c1-7-19-49-43(13-1)44-14-2-8-20-50(44)56(49)40-31-25-37(26-32-40)55(38-27-33-41(34-28-38)57-51-21-9-3-15-45(51)46-16-4-10-22-52(46)57)39-29-35-42(36-30-39)58-53-23-11-5-17-47(53)48-18-6-12-24-54(48)58/h1-36H
InChI Key
AWXGSYPUMWKTBR-UHFFFAOYSA-N
Complexity
1130
Covalently-Bonded Unit Count
1
Exact Mass
740.293997g/mol
Formal Charge
0
Heavy Atom Count
58
Monoisotopic Mass
740.293997g/mol
Rotatable Bond Count
6
XLogP3
14.4
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