Structure

Spiro-2CBP

CAS
924899-38-7
Catalog Number
ACM924899387
Category
Organic Light Emitting Diode (OLED)
Molecular Weight
646.78 g/mol
Molecular Formula
C49H30N2

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Specification

Synonyms
2,7-Bis(carbazol-9-yl)-9,9-spirobifluorene
IUPAC Name
9-(7'-carbazol-9-yl-9,9'-spirobi[fluorene]-2'-yl)carbazole
Canonical SMILES
c1ccc2c(c1)-c3ccccc3C24c5cc(ccc5-c6ccc(cc46)-n7c8ccccc8c9ccccc79)-n%10c%11ccccc%11c%12ccccc%10%12
InChI
InChI=1S/C49H30N2/c1-7-19-41-33(13-1)34-14-2-8-20-42(34)49(41)43-29-31(50-45-21-9-3-15-37(45)38-16-4-10-22-46(38)50)25-27-35(43)36-28-26-32(30-44(36)49)51-47-23-11-5-17-39(47)40-18-6-12-24-48(40)51/h1-30H
InChI Key
UDECBOWBCXTHEY-UHFFFAOYSA-N
Boiling Point
391 - 396 °C
Melting Point
391-396 °C
Application
This material is a popular phosphorescent host material for OLED devices.
Storage
room temp
Complexity
1130
Covalently-Bonded Unit Count
1
Exact Mass
646.240899g/mol
Formal Charge
0
Grade
Sublimed >99% / Unsublimed >98%
H-Bond Acceptor
0
H-Bond Donor
0
Heavy Atom Count
51
MDL Number
MFCD12022464
Monoisotopic Mass
646.240899g/mol
Packaging
1, 5 g in glass bottle
PL Peak
367 nm (in THF)
Rotatable Bond Count
2
TGA
>420 ℃ (0.5% weight loss)
UV Peak
293, 343 nm (in THF)
XLogP3
12.5

Upstream Synthesis Route 1

  • 2052-07-5
  • 924899-38-7

Reference: [1]Usluer, Ozlem; Demic, Serafettin; Egbe, Daniel A. M.; Birckner, Eckhard; Tozlu, Cem; Pivrikas, Almantas; Ramil, Alberto Montaigne; Sariciftci, Niyazi Serdar
[Advanced Functional Materials, 2010, vol. 20, # 23, p. 4152 - 4161]

Upstream Synthesis Route 2

  • 14348-75-5
  • 924899-38-7

Reference: [1]Usluer, Ozlem; Demic, Serafettin; Egbe, Daniel A. M.; Birckner, Eckhard; Tozlu, Cem; Pivrikas, Almantas; Ramil, Alberto Montaigne; Sariciftci, Niyazi Serdar
[Advanced Functional Materials, 2010, vol. 20, # 23, p. 4152 - 4161]

Downstream Synthesis Route 1

  • 924899-38-7
  • 1260496-47-6

Reference: [1]Location in patent: experimental part
Usluer, Ozlem; Demic, Serafettin; Egbe, Daniel A. M.; Birckner, Eckhard; Tozlu, Cem; Pivrikas, Almantas; Ramil, Alberto Montaigne; Sariciftci, Niyazi Serdar
[Advanced Functional Materials, 2010, vol. 20, # 23, p. 4152 - 4161]

* For details of the synthesis route, please refer to the original source to ensure accuracy.

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