Structure of 3,4,5,6-Tetrakis(3,6-diphenyl-9H-carbazol-9-yl)phthalonitrile CAS 1469707-47-8

Iden­ti­fi­ca­tion

CAS Number

1469707-47-8

Name

3,4,5,6-Tetrakis(3,6-diphenyl-9H-carbazol-9-yl)phthalonitrile

Syn­onyms

1,2-Benzenedicarbonitrile, 3,4,5,6-tetrakis(3,6-diphenyl-9H-carbazol-9-yl)- [ACD/​Index Name]
3,4,5,6-Tétrakis(3,6-diphényl-9H-carbazol-9-yl)phtalonitrile [French] [ACD/IUPAC Name]
3,4,5,6-Tetrakis(3,6-diphenyl-9H-carbazol-9-yl)phthalonitril [Ger­man] [ACD/IUPAC Name]
3,4,5,6-Tetrakis(3,6-diphenyl-9H-carbazol-9-yl)phthalonitrile [ACD/IUPAC Name]
1469707-47-8 [RN]
4CzPN-Ph

SMILES

c1ccc(cc1)c2ccc3c(c2)c4cc(ccc4n3c5c(c(c(c(c5n6c7ccc(cc7c8c6ccc(c8)c9ccccc9)c1ccccc1)n1c2ccc(cc2c2c1ccc(c2)c1ccccc1)c1ccccc1)n1c2ccc(cc2c2c1ccc(c2)c1ccccc1)c1ccccc1)C#N)C#N)c1ccccc1

Std­InChI

InChI=1S/C104H64N6/c105-65-91-92(66-106)102(108-95-51-43-77(69-29-13-3-14-30-69)59-85(95)86-60-78(44-52-96(86)108)70-31-15-4-16-32-70)104(110-99-55-47-81(73-37-21-7-22-38-73)63-89(99)90-64-82(48-56-100(90)110)74-39-23-8-24-40-74)103(109-97-53-45-79(71-33-17-5-18-34-71)61-87(97)88-62-80(46-54-98(88)109)72-35-19-6-20-36-72)101(91)107-93-49-41-75(67-25-9-1-10-26-67)57-83(93)84-58-76(42-50-94(84)107)68-27-11-2-12-28-68/h1-64H

Std­InChIKey

YODX­OCMXXD­FKEV-UHF­F­­FAOYSA-N

Mol­e­c­u­lar Formula

C104H64N6

Mol­e­c­u­lar Weight

1397.66

Prop­er­ties

Appear­ance

Orange pow­der

Safe­ty Data

RIDADR 

NONH for all modes of transport

WGK Germany

3

Spec­i­fi­ca­tions and Oth­er Infor­ma­tion of Our 3,4,5,6-Tetrakis(3,6-diphenyl-9H-carbazol-9-yl)phthalonitrile CAS 1469707-47-8

Iden­ti­fi­ca­tion Methods

HNMR, HPLC

Puri­ty

98% min

Shelf Life

2 years

Stor­age

Under room tem­per­a­ture away from light ; If it is iso­lat­ed from water and oxy­gen, it can be stored for a longer time.

Known Appli­ca­tion

It is often used as a ther­mal­ly acti­vat­ed delayed flu­o­res­cence (TADF) mate­r­i­al.

Gen­er­al View of Documents

HNMR of 3,4,5,6-Tetrakis(3,6-diphenyl-9H-carbazol-9-yl)phthalonitrile CAS 1469707-47-8
HNMR of 3,4,5,6-Tetrakis(3,6-diphenyl-9H-carbazol-9-yl)phthalonitrile CAS 1469707-47-8

This prod­uct is devel­oped by our R&D com­pa­ny Warshel Chem­i­cal Ltd (https://​www​.warshel​.com/).

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