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Brc1cnc(nc1)C
Pyrimidine, 5-bromo-2-methyl-
CCCP1(=O)OP(=O)(CCC)OP(=O)(O1)CCC
1,3,5,2,4,6-Trioxatriphosphorinane, 2,4,6-tripropyl-, 2,4,6-trioxide
CC1(C)OB(OC1(C)C)B1OC(C(O1)(C)C)(C)C
2,2'-Bi-1,3,2-dioxaborolane, 4,4,4',4',5,5,5',5'-octamethyl-
O=C(C=Cc1ccccc1)C=Cc1ccccc1.O=C(C=Cc1ccccc1)C=Cc1ccccc1.O=C(C=Cc1ccccc1)C=Cc1ccccc1.[Pd].[Pd]
Tris(dibenzylideneacetone)dipalladium
C1CCC(CC1)P(C1CCCCC1)C1CCCCC1.Cc1cc(C)c(c(c1)C)N1CCN(C1=[Ru](=Cc1ccccc1)(Cl)Cl)c1c(C)cc(cc1C)C
Ruthenium,[1,3-bis(2,4,6-trimethylphenyl)-2-imidazolidinylidene]dichloro(phenylmethylene)(tricyclohexylphosphine)-, (SP-5-41)-

N,N'-Bis(2,6-diisopropylphenyl)-1,6,7,12-tetraphenoxy-3,4,9,10-perylenetetracarboxylicDiimide

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Chemical Name: N,N'-Bis(2,6-diisopropylphenyl)-1,6,7,12-tetraphenoxy-3,4,9,10-perylenetetracarboxylicDiimide
CAS Number: 123174-58-3
Product Number: AG009GMR(AGN-PC-0WNHC5)
Synonyms:
MDL No:
Molecular Formula:
Molecular Weight:

Identification/Properties

Computed Properties
Molecular Weight:
1079.262g/mol
XLogP3:
17.4
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
8
Rotatable Bond Count:
14
Exact Mass:
1078.419g/mol
Monoisotopic Mass:
1078.419g/mol
Topological Polar Surface Area:
112A^2
Heavy Atom Count:
82
Formal Charge:
0
Complexity:
1940
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

Safety Information

GHS Pictogram:
Signal Word:
Warning
UN#:
N/A
Hazard Statements:
H302-H315-H319-H335
Precautionary Statements:
P261-P280-P301+P312-P302+P352-P305+P351+P338
Class:
N/A
Packing Group:
N/A

NMR Spectrum

Other Analytical Data

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Chemical Structure


The N,N-Bis(2,6-diisopropylphenyl)-1,6,7,12-tetraphenoxy-3,4,9,10-perylenetetracarboxylic Diimide is widely used in chemical synthesis as a versatile building block in the preparation of advanced materials. Its unique structure and properties make it an attractive choice for various applications, including:
- Organic semiconductor materials: The diimide can be incorporated into the design of organic semiconductors for use in electronic devices such as organic solar cells, field-effect transistors, and light-emitting diodes. Its electron-accepting properties contribute to the efficient transport of charge carriers within these materials.
- Ligand design in coordination chemistry: The diimide moiety serves as an effective ligand in coordination complexes, enabling the formation of stable and well-defined metal complexes. These complexes find utility in catalysis, sensing, and other advanced applications.
- Supramolecular chemistry: The tetraphenoxy-3,4,9,10-perylenetetracarboxylic framework of the diimide molecule facilitates the assembly of supramolecular structures through non-covalent interactions. These supramolecular assemblies exhibit unique properties and have potential applications in molecular recognition, sensing, and molecular machines.
- Functional materials synthesis: The diimide can be modified to introduce specific functional groups or structural features, allowing for the tailored synthesis of new materials with desired properties. These materials may find use in areas such as optoelectronics, photonics, and biomedical applications.