Ptcdi-C8

Base Information

Chemical Name:Ptcdi-C8
CAS No.:78151-58-3
Molecular Formula:C40H42N2O4
Molecular Weight:614.77
Hs Code.:29251900
European Community (EC) Number:693-748-8
DSSTox Substance ID:DTXSID80443916
Nikkaji Number:J1.484.053B
Wikidata:Q82261904

Synonyms:78151-58-3;PTCDI-C8;N,N'-Di-n-octyl-3,4,9,10-perylenetetracarboxylic Diimide;2,9-dioctylanthra[2,1,9-def:6,5,10-d'e'f']diisoquinoline-1,3,8,10(2H,9H)-tetraone;7,18-dioctyl-7,18-diazaheptacyclo[14.6.2.22,5.03,12.04,9.013,23.020,24]hexacosa-1(23),2,4,9,11,13,15,20(24),21,25-decaene-6,8,17,19-tetrone;N,N'-Dioctyl-3,4,9,10-perylenedicarboximide;Alexf002;Alex002;YSWG762;SCHEMBL418871;DTXSID80443916;MFCD08276854;D4175;FT-0701534;N,N'-Dioctyl-3,4:9,10-perylenebisdicarbimide;T71334;N,N'-Dioctyl-3,4,9,10-perylenedicarboximide, 98%;N,N inverted exclamation mark -Dioctyl-3,4,9,10-perylene dicarboximide

Suppliers and Price of Ptcdi-C8

Supply Marketing:

Business phase:: The product has achieved commercial mass production^*data from LookChem market partment

Manufacturers and distributors:

Manufacture/Brand
Chemicals and raw materials
Packaging
price

TCI Chemical
N,N'-Di-n-octyl-3,4,9,10-perylenetetracarboxylic Diimide >98.0%(N)
1g
$ 135.00

Sigma-Aldrich
N,N′-Dioctyl-3,4,9,10-perylenedicarboximide 98%
1g
$ 130.00

Crysdot
1,3-Dioxo-2-(3-pentylundecyl)-2,3-dihydro-1H-benzo[5,10]anthra[2,1,9-def]isoquinoline-8,9-dicarboxamide 95+%
5g
$ 472.00

American Custom Chemicals Corporation
N,N'-DIOCTYL-3,4,9,10-PERYLENEDICARBOXIMIDE 95.00%
1G
$ 264.39

AK Scientific
Perylene-3,4,9,10-tetracarboxylicacidN,N'-dioctylimide
1g
$ 286.00

Total 17 raw suppliers

Chemical Property of Ptcdi-C8

Chemical Property:

Melting Point:>300 °C
Boiling Point:775.4±33.0 °C(Predicted)
PKA:-2.25±0.20(Predicted)
PSA：78.14000
Density:1.240±0.06 g/cm3(Predicted)
LogP:8.68400
XLogP3:10.5
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:14
Exact Mass:614.31445783
Heavy Atom Count:46
Complexity:996

Purity/Quality:

99%, ^*data from raw suppliers

N,N'-Di-n-octyl-3,4,9,10-perylenetetracarboxylic Diimide >98.0%(N) ^*data from reagent suppliers

Safty Information:

Pictogram(s): Xi
Hazard Codes:Xi
Statements: 36/37/38
Safety Statements: 26

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CCCCCCCCN1C(=O)C2=C3C(=CC=C4C3=C(C=C2)C5=C6C4=CC=C7C6=C(C=C5)C(=O)N(C7=O)CCCCCCCC)C1=O
Uses PTCDI-C8 can be used as an organic semiconductor to fabricate a wide range of opto-electronic based devices such as light emitting diodes, photovoltaic cells, and field effect transistors.

Technology Process of Ptcdi-C8

There total 7 articles about Ptcdi-C8 which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield: 92.0%

: 78151-58-3
N,N'-di(n-octyl)perylene-3,4:9,10-bis(dicarboximide)

Guidance literature:: With pyridine; manganese; sodium formate; cobalt(II) bromide; In N,N-dimethyl acetamide; at 100 ℃; for 8h; Inert atmosphere; Schlenk technique;

Reference yield: 91.0%

: 111-86-4
n-Octylamine

: 128-69-8
perylene-3,4,9,10-tetracarboxylic acid 3,4:9,10-dianhydride

: 78151-58-3
N,N'-di(n-octyl)perylene-3,4:9,10-bis(dicarboximide)

Guidance literature:: In neat (no solvent); at 110 ℃; for 0.133333h; Green chemistry;
DOI:10.1002/anie.201913625

Reference yield: 89.0%

: C₄₀H₄₂N₂O₅S

: 78151-58-3
N,N'-di(n-octyl)perylene-3,4:9,10-bis(dicarboximide)

Guidance literature:: C₄₀H₄₂N₂O₅S; With bis(pentamethylcyclopentadienyl)cobalt(II); In dichloromethane; at 20 ℃; for 0.333333h; Glovebox;

With chloranil; In dichloromethane; at 20 ℃; Reagent/catalyst; Solvent; Temperature; Time; Wavelength; Mechanism; Glovebox;
DOI:10.1021/jacs.0c04096