CAS 185690-39-5 1T-NATA - Materials / Alfa Chemistry

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Organic Light-Emitting Diode (OLED) Materials

1T-NATA

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Catalog Number

ACM185690395

Product Name

1T-NATA

Structure

CAS

185690-39-5

Category

Organic Light-Emitting Diode (OLED) Materials

Synonyms

4,4',4''-TRIS(N-(1-NAPHTHYL)-N-PHENYL-AMINO)-TRIPHENYLAMINE;4,4',4''-TRIS(N-(NAPHTHYLEN-1-YL)-N-PHENYLAMINO)TRIPHENYLAMINE;4,4',4" -Tris(N-(naphthalen-1-yl)-N-phenyl-amino)triphenylamine

IUPAC Name

4-N-naphthalen-1-yl-1-N,1-N-bis[4-(N-naphthalen-1-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=CC=CC6=CC=CC=C65)C7=CC=C(C=C7)N(C8=CC=CC=C8)C9=CC=CC1=CC=CC=C19)C1=CC=CC2=CC=CC=C21

InChI

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

InChI Key

CRHRWHRNQKPUPO-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