3,3'-Di(9H-carbazol-9-yl)-1,1'-biphenyl(m-CBP) - sublimed grade , CAS No.342638-54-4

CAS: 342638-54-4 Cat. No.: M478484 Fórmula: C₃₆H₂₄N₂ Peso molecular: 484.6 Número EC: 803-683-0

CALIDAD & PUREZA Sublimed grade

Synonyms

AC-33721 | 3,3'-Di(9H-carbazol-9-yl)biphenyl | 3,3-Di(9H-carbazol-9-yl)biphenyl | 9-[3-(3-Carbazol-9-ylphenyl)phenyl]carbazole | FT-0710397 | m-CBP, sublimed | MFCD28138084 | 3,3'-Di(9H-carbazol-9-yl)-1,1'-biphenyl (MCBP) | SB66673 | AKOS027338504 | A9001

Storage

Room temperature,Argon charged

Shipped In

Normal

Descripción general

Description

Phosphorescent host material and TADF emitter in OLEDs.}

Especificaciones

Sinónimos

AC-33721 | 3,3'-Di(9H-carbazol-9-yl)biphenyl | 3,3-Di(9H-carbazol-9-yl)biphenyl | 9-[3-(3-Carbazol-9-ylphenyl)phenyl]carbazole | FT-0710397 | m-CBP, sublimed | MFCD28138084 | 3,3'-Di(9H-carbazol-9-yl)-1,1'-biphenyl (MCBP) | SB66673 | AKOS027338504 | A9001

Especificaciones y pureza

sublimed grade

Condiciones de almacenamiento de almacenamiento

Room temperature,Argon charged

Enviado en

Normal

Grado

Calidad sublimada

Nombres e identificadores

Sonrisas canónicas

C1=CC=C2C(=C1)C3=CC=CC=C3N2C4=CC=CC(=C4)C5=CC(=CC=C5)N6C7=CC=CC=C7C8=CC=CC=C86

IUPAC Name

9-[3-(3-carbazol-9-ylphenyl)phenyl]carbazole

InChIKey

NSXJEEMTGWMJPY-UHFFFAOYSA-N

INCHI

1S/C36H24N2/c1-5-19-33-29(15-1)30-16-2-6-20-34(30)37(33)27-13-9-11-25(23-27)26-12-10-14-28(24-26)38-35-21-7-3-17-31(35)32-18-4-8-22-36(32)38/h1-24H

Isómeros SMILES

C1=CC=C2C(=C1)C3=CC=CC=C3N2C4=CC=CC(=C4)C5=CC(=CC=C5)N6C7=CC=CC=C7C8=CC=CC=C86

Peso molecular

484.6

Reaxy-Rn

22090916

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=22090916&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organoheterocyclic compounds
    • Clase Indoles and derivatives
      • Subclass Carbazoles

• Kingdom: Organic compounds
• Superclass: Organoheterocyclic compounds
• Clase: Indoles and derivatives
• Subclass: Carbazoles
• Intermediate Tree Nodes: Not available
• Direct Parent: Carbazoles
• Alternative Parents: Biphenyls and derivatives Phenylpyrroles Indoles Heteroaromatic compounds Azacyclic compounds Organonitrogen compounds Hydrocarbon derivatives
• Molecular Framework: Aromatic heteropolycyclic compounds
• Substituents: Carbazole - Biphenyl - 1-phenylpyrrole - Indole - Benzenoid - Substituted pyrrole - Monocyclic benzene moiety - Heteroaromatic compound - Pyrrole - Azacycle - Organic nitrogen compound - Hydrocarbon derivative - Organonitrogen compound - Aromatic heteropolycyclic compound
• Descripción: This compound belongs to the class of organic compounds known as carbazoles. These are compounds containing a three ring system containing a pyrrole ring fused on either side to a benzene ring.
• External Descriptors: Not available

Data sources

1. Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS. ClassyFire: Automated Chemical Classification With A Comprehensive, Computable Taxonomy. Journal of Cheminformatics, 2016, 8:61.

DOI: 10.1186/s13321-016-0174-y

Propiedades químicas y físicas

• Sensibilidad: Air sensitive;Moisture sensitive;Heat sensitive
• Punto de fusión (°C): 267 °C
• Peso molecular: 484.600 g/mol
• XLogP3: 9.700
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 0
• Rotatable Bond Count: 3
• Exact Mass: 484.194 Da
• Monoisotopic Mass: 484.194 Da
• Topological Polar Surface Area: 9.900 Ų
• Heavy Atom Count: 38
• Formal Charge: 0
• Complexity: 699.000
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 0
• Undefined Atom Stereocenter Count: 0
• Defined Bond Stereocenter Count: 0
• Undefined Bond Stereocenter Count: 0
• The total count of all stereochemical bonds: 0
• Covalently-Bonded Unit Count: 1