Poly[bis(4-​phenyl)​(2,4,6-​trimethylphenyl)​amine] - Mw=15000-25000 , CAS No.1333317-99-9

CAS: 1333317-99-9 Cat. No.: P292965 PubChem CID: 19734974

GRADE & PURITY Mw=15000-25000

Synonyms

1333317-99-9 | DTXSID70599416 | AKOS022172920 | N,N-diphenyl-2,4,6-triMethyl aniline | TAA; N,N-diphenyl-2,4,6-trimethylaniline, >99%(HPLC), Sublimed | SCHEMBL3477723 | 2,4,6-Trimethyl-N,N-diphenylaniline

Storage

Protected from light,Room temperature,Argon charged

Shipped In

Normal

Overview

PTAA (polytriarylamine) semiconductor is an organic p-type semiconductor with high hole mobility of 10−3 to 10−2 cm2 V−1 s−1, which can achieve high carrier mobility. It is a stable glassy polymer with good ionization potential for thick film diodes.
We are committed to bringing you greener alternatives that adhere to one or more of the 12 principles of green chemistry. This product is an enabling product for green alternatives and meets the principle of "energy-saving design". The hole transport organic material perfectly matches the energy level arrangement of the absorption layer, thereby achieving efficient charge collection, and it is easily degraded under ambient conditions.
Application
PTAA can be used as a substrate material coating in the manufacture of many hole transport devices (such as perovskite solar cells, polymer light-emitting diodes and organic field-effect transistors).

Specifications

Synonyms

1333317-99-9 | DTXSID70599416 | AKOS022172920 | N, N-diphenyl-2, 4, 6-triMethyl aniline | TAA; N, N-diphenyl-2, 4, 6-trimethylaniline, >99%(HPLC), Sublimed | SCHEMBL3477723 | 2, 4, 6-Trimethyl-N, N-diphenylaniline

Specifications & Purity

Mw=15000-25000

Storage

Protected from light, Room temperature, Argon charged

Shipped In

Normal

Names and Identifiers

• Canonical Smiles: CC1=CC(=C(C(=C1)C)N(C2=CC=CC=C2)C3=CC=CC=C3)C
• IUPAC Name: 2,4,6-trimethyl-N,N-diphenylaniline
• InChIKey: TZJRFZZCRASCAW-UHFFFAOYSA-N
• INCHI: 1S/C21H21N/c1-16-14-17(2)21(18(3)15-16)22(19-10-6-4-7-11-19)20-12-8-5-9-13-20/h4-15H,1-3H3
• Isomeric SMILES: CC1=CC(=C(C(=C1)C)N(C2=CC=CC=C2)C3=CC=CC=C3)C
• PubChem CID: 19734974

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organic nitrogen compounds
    • Class Organonitrogen compounds
      • Subclass Amines
        • Level5 Tertiary amines
          • Level6 Triarylamines

• Kingdom: Organic compounds
• Superclass: Organic nitrogen compounds
• Class: Organonitrogen compounds
• Subclass: Amines
• Intermediate Tree Nodes: Tertiary amines
• Direct Parent: Triarylamines
• Alternative Parents: Aniline and substituted anilines Hydrocarbon derivatives
• Molecular Framework: Aromatic homomonocyclic compounds
• Substituents: Tertiary aromatic amine - Aniline or substituted anilines - Benzenoid - Monocyclic benzene moiety - Hydrocarbon derivative - Aromatic homomonocyclic compound
• Description: This compound belongs to the class of organic compounds known as triarylamines. These are organic compounds containing a trialkylamine group, characterized by exactly three aryl groups bonded to the amino nitrogen.
• 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

Chemical and Physical Properties

• Solubility: Soluble in Chloroform，THF，Toluene and Chlorobenzene et al
• Sensitivity: light & air sensitive
• Melt Point(°C): >400 °C
• Molecular Weight: 287.400 g/mol
• XLogP3: 6.300
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 3
• Exact Mass: 287.167 Da
• Monoisotopic Mass: 287.167 Da
• Topological Polar Surface Area: 3.200 Ų
• Heavy Atom Count: 22
• Formal Charge: 0
• Complexity: 297.000
• 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

References

1. Haipeng Zeng, Lin Li, Fengxiang Liu, Min Li, Shujing Zhang, Xin Zheng, Long Luo, Shuai You, Yang Zhao, Rui Guo, Zhongmiao Gong, Rong Huang, Zhe Li, Ti Wang, Yi Cui, Yaoguang Rong, Xiong Li.  (2021)  Improved Performance and Stability of Perovskite Solar Modules by Regulating Interfacial Ion Diffusion with Nonionic Cross-Linked 1D Lead-Iodide.  Advanced Energy Materials,  12  (1): (2102820).  [PMID:] [10.1002/aenm.202102820]