Structure

TmPyPB

CAS
921205-03-0
Catalog Number
ACM921205030-4
Category
Organic Light Emitting Diode (OLED)
Molecular Weight
537.65 g/mol
Molecular Formula
C39H27N3

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Specification

Synonyms
135-Tri[(3-pyridyl)-phen-3-yl]benzene
IUPAC Name
3-[3-[3,5-bis(3-pyridin-3-ylphenyl)phenyl]phenyl]pyridine
Canonical SMILES
C1(C2=CC=CC(C3=CN=CC=C3)=C2)=CC(C4=CC=CC(C5=CN=CC=C5)=C4)=CC(C6=CC=CC(C7=CN=CC=C7)=C6)=C1
InChI
1S/C39H27N3/c1-7-28(34-13-4-16-40-25-34)19-31(10-1)37-22-38(32-11-2-8-29(20-32)35-14-5-17-41-26-35)24-39(23-37)33-12-3-9-30(21-33)36-15-6-18-42-27-36/h1-27H,CINYXYWQPZSTOT-UHFFFAOYSA-N
InChI Key
CINYXYWQPZSTOT-UHFFFAOYSA-N
Melting Point
195-200 °C
Solubility
Soluble in CH2Cl2 CHCl3, Toluene
Application
Electron-transport and hole/exciton-blocking materail with high electron mobility (10-4-10-3 cm2 V-1 s-1) and high triplet energy level (2.75 eV) for highly efficient phosphorescent OLEDs application.
Storage
room temp
Complexity
697
Covalently-Bonded Unit Count
1
Exact Mass
537.220498g/mol
Formal Charge
0
Grade
Sublimed >99.8% / Sublimed >99.5%
H-Bond Acceptor
3
H-Bond Donor
0
Heavy Atom Count
42
MDL Number
MFCD16621131
Monoisotopic Mass
537.220498g/mol
Packaging
1, 5 g in glass bottle
PL Peak
353 nm (in CH2Cl2)
Rotatable Bond Count
6
TGA
>310 ℃ (0.5% weight loss)
UV Peak
254 nm (in CH2Cl2)
XLogP3
8.5
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