Anthra(2,1,9-def:6,5,10-d'e'f')diisoquinoline-1,3,8,10(2H,9H)-tetrone,2,9-bis(2,5-bis(1,1-dimethylethyl)phenyl)-
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Basic information
- CAS
83054-80-2- Standard SMILES
CC(C)(C)c1ccc(C(C)(C)C)c(N2C(=O)c3ccc4c5ccc6c7c(ccc(c8ccc(c3c48)C2=O)c75)C(=O)N(c2cc(C(C)(C)C)ccc2C(C)(C)C)C6=O)c1- InChIKey
BIYPCKKQAHLMHG-UHFFFAOYSA-N- Molecular formula
- C52H50N2O4
- Average molar mass
- 766.982 g/mol
- Monoisotopic mass
- 766.37705808
Names & identifiers
- Preferred name
- Anthra(2,1,9-def:6,5,10-d'e'f')diisoquinoline-1,3,8,10(2H,9H)-tetrone,2,9-bis(2,5-bis(1,1-dimethylethyl)phenyl)-
- IUPAC
- 2,9-Bis(2,5-di-tert-butylphenyl)isoquinolino[4',5',6':6,5,10]anthra[2,1,9-def]isoquinoline-1,3,8,10(2H,9H)-tetrone
- English name
- N N'-bis(2 5-di-t-Bu-phenyl)-3 4 9 10-
- Molecular formula
- C52H50N2O4
- Molecular weight
- 766.96
Names & synonyms
BTBPPDCDTN N'-bis(2 5-di-t-Bu-phenyl)-3 4 9 10-N,N-bis(2,5-di-T-butylphenyl)-3,4*9,10-perylenedN,N'-bis(2,5-di-T-bu-phenyl)-3,4,9,10-perylenedicN,N'-Bis(2,5-di-tert-butylphenyl)-3,4,9,10-peryleneN,N'-bis(2,5-dibutylphenyl)-3,4,9,10-perylenedicarboxamideN,N'-BIS(2,5-DI-T-BU-PHENYL)-3,4,9,10-PE RYLENEDICARBOXIMIDEN,N'-Bis(2,5-di-tert-butylphenyl)-3,4,9,10-perylenedicarboximideN,N'-Bis(2,5-di-tert-butylphenyl)-3,4,9,10-perylene dicarboximide
Database identifiers
- CAS
83054-80-2- PubChem CID
- 158299
- DTXSID
DTXSID60232148- UNII
- D9W84U7KO3
- EC Number
- 633-619-5
- Nikkaji
- J621.838E
Properties
Physicochemical properties
- Melting point
- 300 °C · >300 °C(lit.)
- Density
- 1.242 · 1.242±0.06 g/cm3(Predicted)
- pka
- 3.7 · 3.70±0.20(Predicted)
- form
- solid
- semiconductor properties
- N-type (mobility=1.8x10-4cm2/V·s)
- λmax
- 528 nm · 528 nm
- FDA UNII
- 9 W84U7KO3 · D9W84U7KO3
- EPA Substance Registry System
- 2 · Anthra[2,1,9-def:6,5,10-d'e'f']diisoquinoline-1,3,8,10(2H,9H)-tetrone, 2,9-bis[2,5-bis(1,1-dimethylethyl)phenyl]- (83054-80-2)
- UNSPSC Code
- 12352103 · 12352103
- NACRES
- 23 · NA.23
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 315 · H315-H319-H335
- Precautionary statements
- 261 · P261-P264-P271-P280-P302+P352-P305+P351+P338
- Hazard Codes
- Xi
- Risk Statements
- 36 · 36/37/38
- Safety Statements
- 26 · 26-36
- WGK Germany
- 3 · 3
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- wgk
- 3
- risk_code
- 36/37/38
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- hazard_code
- Xi
- safety_code
- 26-36
- Hazard statements
- H315-H319-H335
- Precautionary statements
- P261-P264-P271-P280-P302+P352-P305+P351+P338
Chemistry & industry
Applications
UsesBTBP is a dye that can be used in the development of organic electronic based devices which include organic light emitting diodes(OLED), electroluminescent device and organic solar cells(OSCs).
General DescriptionN,N′-Bis(2,5-di-tert-butylphenyl)-3,4,9,10-perylenedicarboximide (BTBP) is a fluorescence dye that can be used as an electron acceptor. It has an extinction coefficient of 7.4 x 104 cm-1 mol-1 dm3.
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