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932426

Sigma-Aldrich

4,4′,4′′-Tris(N-(naphthalen-2-yl)-N-phenyl-amino)-triphenylamine

≥99% (HPLC)

Synonym(s):

4,4′,4′′-Tris[2-naphthyl(phenyl)amino]triphenylamine, 2T-NATA, 2-TNATA, 2TNATA

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About This Item

Empirical Formula (Hill Notation):
C66H48N4
CAS Number:
Molecular Weight:
897.11
MDL number:
UNSPSC Code:
12352116
NACRES:
NA.23

grade

sublimed grade

Quality Level

description

μh ≈ 3.0 x 10-6 cm2 V−1 s−1

Assay

≥99% (HPLC)

loss

0.5% TGA, > 350 °C (weight loss)

mp

247 °C

solubility

THF: soluble
chloroform: soluble

fluorescence

λem 490 nm±10 nm in THF

Orbital energy

HOMO 5.1 eV 
LUMO 2.2 eV 

λ

in THF

UV absorption

λ: 326 nm±5 nm Amax

SMILES string

c1ccc(cc1)N(c2ccc(cc2)N(c3ccc(cc3)N(c4ccccc4)c5ccc6ccccc6c5)c7ccc(cc7)N(c8ccccc8)c9ccc%10ccccc%10c9)c%11ccc%12ccccc%12c%11

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

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Application

4,4′,4′′-Tris(N-(naphthalen-2-yl)-N-phenyl-amino)-triphenylamine can be used in various applications in organic electronics and materials chemistry such as organic Light-Emitting Diodes (OLEDs), organic Photovoltaics(OPVs), organic Field-Effect Transistors (OFETs), dye-sensitized solar Cells(DSSCs), as a hole transport material. It can be utilized in the assembly of supramolecular structures or coordination polymers, offering opportunities for the design and synthesis of functional materials.
Injection Layer (HIL) in Organic Light Emitting Diode (OLED).

Storage Class Code

11 - Combustible Solids

WGK

WGK 3

Flash Point(F)

Not applicable

Flash Point(C)

Not applicable


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