NAVIGATION


1,3-Bis[5-(4-tert-butylphenyl)-2-[1,3,4]oxadiazolyl]benzene

Catalog NumberACM138372675-1

CAS Number138372-67-5

CategoryOrganic Light-Emitting Diode (OLED) Materials

1,3-Bis[5-(4-tert-butylphenyl)-2-[1,3,4]oxadiazolyl]benzene
Synonyms
1,3-Bis[5-(4-tert-butylphenyl)-1,3,4-oxadiazol-2-yl]benzene
OXD-7
IUPAC Name
2-(4-tert-butylphenyl)-5-[3-[5-(4-tert-butylphenyl)-1,3,4-oxadiazol-2-yl]phenyl]-1,3,4-oxadiazole
Molecular Weight
478.60
Molecular Formula
C30H30N4O2
Canonical SMILES
CC(C)(C)C1=CC=C(C=C1)C2=NN=C(O2)C3=CC(=CC=C3)C4=NN=C(O4)C5=CC=C(C=C5)C(C)(C)C
InChI
InChI=1S/C30H30N4O2/c1-29(2,3)23-14-10-19(11-15-23)25-31-33-27(35-25)21-8-7-9-22(18-21)28-34-32-26(36-28)20-12-16-24(17-13-20)30(4,5)6/h7-18H,1-6H3
InChI Key
FQJQNLKWTRGIEB-UHFFFAOYSA-N
Melting Point
241 °C
Purity
>97.0%(HPLC)
Appearance
White to Almost white powder to crystal
Application
The purpose of 1,3-Bis[5-(4-tert-butylphenyl)-2-[1,3,4]oxadiazolyl]benzene is to serve as an electron-transporting material, leveraging the electron-accepting properties of its oxadiazole units. This compound is particularly valued when used in conjunction with poly(9-vinylcarbazole) (PVK), an electron donor, due to its hybrid nature. It boasts excellent solubility and film-forming capabilities, attributed to the presence of bulky tert-butyl groups, making it a popular choice among hybrid host materials. In addition, it has been employed as an ultraviolet emitter with the use of MoO3 for hole injection and buffering, achieving relatively high external quantum efficiency.
Storage
Store under inert gas
Complexity
645
Covalently-Bonded Unit Count
1
Exact Mass
478.236876g/mol
Formal Charge
0
Heavy Atom Count
36
MDL Number
MFCD03093214
Monoisotopic Mass
478.236876g/mol
Rotatable Bond Count
6
XLogP3
7.6
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