Structure

Bathocuproine

CAS
4733-39-5
Catalog Number
ACM4733395
Category
Solution-Processed OLED
Molecular Weight
360.46
Molecular Formula
C26H20N2

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Specification

Description
TGA/DSC Lot specific traces available upon request
Synonyms
2,9-Dimethyl-4,7-diphenyl-1,10-phenanthroline
IUPAC Name
2,9-dimethyl-4,7-diphenyl-1,10-phenanthroline;
Canonical SMILES
Cc1cc(-c2ccccc2)c3ccc4c(cc(C)nc4c3n1)-c5ccccc5
InChI
InChI=1S/C26H20N2/c1-17-15-23(19-9-5-3-6-10-19)21-13-14-22-24(20-11-7-4-8-12-20)16-18(2)28-26(22)25(21)27-17/h3-16H,1-2H3
InChI Key
STTGYIUESPWXOW-UHFFFAOYSA-N
Melting Point
283 °C
Solubility
soluble in Ethanol,Methanol,Acetone,Benzene
Appearance
White to Light yellow to Green powder to crystaline
Application
Organic electronic material useful as OLED electron transporter and hole blocker.
Storage
Store under inert gas
Assay
0.96
Complexity
461
Condition To Avoid
Light Sensitive
Covalently-Bonded Unit Count
1
EC Number
225-240-5
Exact Mass
360.163g/mol
Form
ITO/CuPc/NPD/TCTA/mCP:FIrpic (6%)/BCP/LiF/Al• Color: blue• Max. EQE: 4.2 %
Grade
sublimed grade
Hazard Statements
H302 : Harmful if swallowed.H413 : May cause long lasting harmful effects to aquatic life.
H-Bond Acceptor
2
Heavy Atom Count
28
MDL Number
MFCD00004972
Monoisotopic Mass
360.163g/mol
NSC Number
89195
Packaging
1 g in glass bottle
Precautionary Statements
P501 : Dispose of contents/ container to an approved waste disposal plant.P273 : Avoid release to the environment.P270 : Do not eat, drink or smoke when using this product.P264 : Wash skin thoroughly after handling.P301 + P312 + P330 : IF SWALLOWED: Call a POISON CENTER/doctor if you feel unwell. Rinse mouth.
Quality Level
100
Rotatable Bond Count
2
Signal Word
Warning
Topological Polar Surface Area
25.8A^2
UNII
9THP2V94FX
What is the molecular formula of Bathocuproine?

The molecular formula of Bathocuproine is C26H20N2.

What is the molecular weight of Bathocuproine?

The molecular weight of Bathocuproine is 360.4 g/mol.

What is the IUPAC name of Bathocuproine?

The IUPAC name of Bathocuproine is 2,9-dimethyl-4,7-diphenyl-1,10-phenanthroline.

What is the InChI of Bathocuproine?

The InChI of Bathocuproine is InChI=1S/C26H20N2/c1-17-15-23(19-9-5-3-6-10-19)21-13-14-22-24(20-11-7-4-8-12-20)16-18(2)28-26(22)25(21)27-17/h3-16H,1-2H3.

What is the InChIKey of Bathocuproine?

The InChIKey of Bathocuproine is STTGYIUESPWXOW-UHFFFAOYSA-N.

What is the synonyms of Bathocuproine?

The synonyms of Bathocuproine include 2,9-Dimethyl-4,7-diphenyl-1,10-phenanthroline and Bathocuproin.

What is the CAS number of Bathocuproine?

The CAS number of Bathocuproine is 4733-39-5.

What is the EC number of Bathocuproine?

The EC number of Bathocuproine is 225-240-5.

What is the ChEMBL ID of Bathocuproine?

The ChEMBL ID of Bathocuproine is CHEMBL220061.

Is Bathocuproine listed in Wikipedia?

Yes, Bathocuproine is listed in Wikipedia.

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