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N,N'-Diphenyl-N,N'-bis(p-tolyl)-1,4-phenylenediamine

Catalog Number
ACM138171149-2
CAS Number
138171-14-9
Product Name
N,N'-Diphenyl-N,N'-bis(p-tolyl)-1,4-phenylenediamine
Structure
Category
Organic Light-Emitting Diode (OLED) Materials
Synonyms
4',4'''-Dimethyl-N,N,N',N'-tetraphenyl-1,4-phenylenediamine
IUPAC Name
1-N,4-N-bis(4-methylphenyl)-1-N,4-N-diphenylbenzene-1,4-diamine
Molecular Weight
440.59
Molecular Formula
C32H28N2
Canonical SMILES
CC1=CC=C(C=C1)N(C2=CC=CC=C2)C3=CC=C(C=C3)N(C4=CC=CC=C4)C5=CC=C(C=C5)C
InChI
InChI=1S/C32H28N2/c1-25-13-17-29(18-14-25)33(27-9-5-3-6-10-27)31-21-23-32(24-22-31)34(28-11-7-4-8-12-28)30-19-15-26(2)16-20-30/h3-24H,1-2H3
InChI Key
FQNVFRPAQRVHKO-UHFFFAOYSA-N
Melting Point
193 °C
Purity
>97.0%(HPLC)
Appearance
White to Light yellow powder to crystal
Application
Hole-transport material for blue to yellow emitting OLEDs with aluminum quinolate (Alq3) derivatives.
Storage
Store under inert gas
Complexity
516
Covalently-Bonded Unit Count
1
Exact Mass
440.225249g/mol
Formal Charge
0
Hazard Statements
H351 : Suspected of causing cancer.
Heavy Atom Count
34
MDL Number
MFCD01310665
Monoisotopic Mass
440.225249g/mol
Precautionary Statements
P501 : Dispose of contents/ container to an approved waste disposal plant.P202 : Do not handle until all safety precautions have been read and understood.P201 : Obtain special instructions before use.P280 : Wear protective gloves/ protective clothing/ eye protection/ face protection.P308 + P313 : IF exposed or concerned: Get medical advice/ attention.P405 : Store locked up.
Rotatable Bond Count
6
Signal Word
Warning
XLogP3
9.1
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