CAS 185690-41-9 4,4',4''-Tris[2-naphthyl(phenyl)amino]triphenylamine, 97.0%

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Organic Light-Emitting Diode (OLED) Materials

4,4',4''-Tris[2-naphthyl(phenyl)amino]triphenylamine, 97.0%

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Catalog Number

ACM185690419-1

Product Name

4,4',4''-Tris[2-naphthyl(phenyl)amino]triphenylamine, 97.0%

Structure

CAS

185690-41-9

Category

Organic Light-Emitting Diode (OLED) Materials

IUPAC Name

4-N-naphthalen-2-yl-1-N,1-N-bis[4-(N-naphthalen-2-ylanilino)phenyl]-4-N-phenylbenzene-1,4-diamine

Molecular Weight

897.1g/mol

Molecular Formula

C66H48N4

Canonical SMILES

C1=CC=C(C=C1)N(C2=CC=C(C=C2)N(C3=CC=C(C=C3)N(C4=CC=CC=C4)C5=CC6=CC=CC=C6C=C5)C7=CC=C(C=C7)N(C8=CC=CC=C8)C9=CC1=CC=CC=C1C=C9)C1=CC2=CC=CC=C2C=C1

InChI

InChI=1S/C66H48N4/c1-4-22-55(23-5-1)68(64-31-28-49-16-10-13-19-52(49)46-64)61-40-34-58(35-41-61)67(59-36-42-62(43-37-59)69(56-24-6-2-7-25-56)65-32-29-50-17-11-14-20-53(50)47-65)60-38-44-63(45-39-60)70(57-26-8-3-9-27-57)66-33-30-51-18-12-15-21-54(51)48-66/h1-48H

InChI Key

KDOQMLIRFUVJNT-UHFFFAOYSA-N

Complexity

1360

Covalently-Bonded Unit Count

Exact Mass

896.387898g/mol

Formal Charge

Heavy Atom Count

Monoisotopic Mass

896.387898g/mol

Rotatable Bond Count