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550378-78-4

550378-78-4 Structure

550378-78-4 Structure
IdentificationBack Directory
[Name]

9,9'-(1,3-Phenylene)bis-9H-carbazole
[CAS]

550378-78-4
[Synonyms]

9,9´
9,9'-(1,3-Phenylene)
1,3-Di(9H-carbazol-9-yl)
1,3-Di-9-carbazolylbenzene
1,3-Bi(carbazol-9-yl)benzene
1,3-Bis(N-carbazolyl)benzene
N,N'-Dicarbazolyl-3,5-benzene
1,3-Bis(carbazol-9-yl)benzene
MCP,1,3-Di-9-carbazolylbenzene
1,3-di(9H-carbazol-9-yl)benzene
-(1,3-Phenylene)bis-9H-carbazole
9-(3-carbazol-9-ylphenyl)carbazole
9,9'-(1,3-Phenylene)bis-9H-carbazole
9H-Carbazole, 9,9'-(1,3-phenylene)bis-
MCP , 9,9'-(1,3-Phenylene)bis-9H-carbazole
9-(3-(9H-carbazol-9-yl)phenyl)-9H-carbazole
9H-carbazole-9,9’-(1,3-phenylene)- bis-(9C1)
1,3-Di-9-carbazolylbenzene (purified by subliMation)
[Molecular Formula]

C30H20N2
[MDL Number]

MFCD09836836
[MOL File]

550378-78-4.mol
[Molecular Weight]

408.49
Chemical PropertiesBack Directory
[Melting point ]

176-178°C
[Boiling point ]

644.2±51.0 °C(Predicted)
[density ]

1.21
[storage temp. ]

Sealed in dry,Room Temperature
[form ]

powder to crystal
[color ]

White to Almost white
[λmax]

292338 nm
[InChI]

InChI=1S/C30H20N2/c1-5-16-27-23(12-1)24-13-2-6-17-28(24)31(27)21-10-9-11-22(20-21)32-29-18-7-3-14-25(29)26-15-4-8-19-30(26)32/h1-20H
[InChIKey]

MZYDBGLUVPLRKR-UHFFFAOYSA-N
[SMILES]

C1(N2C3=C(C=CC=C3)C3=C2C=CC=C3)=CC=CC(N2C3=C(C=CC=C3)C3=C2C=CC=C3)=C1
[Absorption]

λmax 292, 338 nm (in THF)
[Odor]

White powder
Hazard InformationBack Directory
[Uses]

Material for use as a phosphorescent host material
[Description]

1,3-Bis(N-carbazolyl)benzene, known as mCP, with a high triplet energy (ET ?= 2.91 eV) and a very deep highest occupied?molecular orbital (HOMO) level, is often used as host materials for efficient blue phosphorescent light-emitting diodes. Kawamura et al. demonstrated that the photoluminescence internal quantum yield of the blue emitter of FIrpic could approach nearly 100% when doped into the wide energy gap host of mCP .
[References]

[1] JUAN MENTADO-MORALES. A Promising Thermodynamic Study of Hole Transport Materials to Develop Solar Cells: 1,3-Bis(N-carbazolyl)benzene and 1,4-Bis(diphenylamino)benzene.[J]. Molecules, 2022. DOI:10.3390/molecules27020381.
[2] DAE-KYU KIM; Jong H C; Yoo Lim Kim. Organic Light-Emitting Transistors Based on Pentacene and 4,5-Di(9H-carbazol-9-yl)phthalonitrile Doped onto 1,3-Bis(N-carbazolyl)benzene[J]. The Journal of Physical Chemistry C, 2019. DOI:10.1021/acs.jpcc.9b00150.
Safety DataBack Directory
[Hazard Codes ]

Xi
[Risk Statements ]

37/38-41
[Safety Statements ]

26-36/37/39-41-37/38
[WGK Germany ]

3
[HS Code ]

29339900
Questions And AnswerBack Directory
[Applications]

1,3-Bis(N-carbazolyl)benzene (NCB) can be used for:
(1) development of hole transport materials for solar cells. NCB is more stable than 1,4-Bis(diphenylamino)benzene (DAB)[1].
(2) As an organic semiconductor layer component for the preparation of multilayer organic-based light-emitting transistors (OLETs)[2].
(3) Used as a material for phosphorescent host materials
(4) Used as an organic synthetic backbone material
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