3-phenyl-9H-carbazole

Base Information

• Chemical Name: 3-phenyl-9H-carbazole
• CAS No.: 103012-26-6
• Molecular Formula: C18H13N
• Molecular Weight: 243.308
• European Community (EC) Number: 833-765-1
• ChEMBL ID: CHEMBL1173064
• Nikkaji Number: J2.541.532I
• Mol file: 103012-26-6.mol

Synonyms:3-phenyl-9H-carbazole;103012-26-6;3-phenylcarbazole;MFCD22052094;SCHEMBL321006;CHEMBL1173064;IAWRFMPNMXEJCK-UHFFFAOYSA-N;AKOS027383982;DS-13435;SY120766;CS-0156406;P2401;F15285;A907078

Chemical Property of 3-phenyl-9H-carbazole

Chemical Property:

• Melting Point: 222.8-224.1℃
• Boiling Point: 474.3±14.0 °C(Predicted)
• PKA: 16.97±0.30(Predicted)
• PSA: 15.79000
• Density: 1.208±0.06 g/cm3(Predicted)
• LogP: 4.98810
• Storage Temp.: Sealed in dry,Room Temperature
• XLogP3: 5.3
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 0
• Rotatable Bond Count: 1
• Exact Mass: 243.104799419
• Heavy Atom Count: 19
• Complexity: 307

Purity/Quality:

98% ^*data from raw suppliers

3-Phenyl-9H-carbazole ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC=C(C=C1)C2=CC3=C(C=C2)NC4=CC=CC=C43
• Uses: 3-Phenyl-9H-carbazole is a useful research chemical.

Technology Process of 3-phenyl-9H-carbazole

There total 26 articles about 3-phenyl-9H-carbazole which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield: 96.0%

3-bromo-9H-carbazole (1592-95-6) + phenylboronic acid (98-80-6) → 3-phenyl-9H-carbazole (103012-26-6)

Guidance literature:

With tetrakis(triphenylphosphine) palladium⁽⁰⁾; potassium carbonate; In tetrahydrofuran; water; for 4h; Reflux; Inert atmosphere;

DOI:10.1016/j.dyepig.2021.109808

Reference yield: 96.0%

(E)-N-(2-(1H-indol-3-yl)ethyl)-4-phenylbut-3-enamide → 3-phenyl-9H-carbazole (103012-26-6)

Guidance literature:

With trichlorophosphate; In acetonitrile; for 1h; Reflux;

DOI:10.1021/acs.orglett.1c00785

Reference yield: 86.0%

N-(2-chlorophenyl)[1,1′-biphenyl]-4-amine (1160823-30-2) → 3-phenyl-9H-carbazole (103012-26-6)

Guidance literature:

With potassium tert-butylate; In dimethyl sulfoxide; for 1h; UV-irradiation;

DOI:10.1021/jo9006249

upstream raw materials:

3-diazo-3H-carbazole

benzene

6-phenyl-2,3,4,9-tetrahydro-1H-carbazole

9H-carbazol-9-amine

Downstream raw materials:

CzPAP

9-[4-(benzoxazol-2-yl)phenyl]-3-phenyl-9H-carbazole

3,9-diphenyl-9H-carbazole

Refernces

• 1、 Guo, Runda,Liu, Wei,Lv, Xialei,Sun, Shuaiqiang,Wang, Lei,Wang, Yaxiong,Ye, Shaofeng,Zhang, Qing. "A strategy to construct multifunctional TADF materials for deep blue and high efficiency yellow fluorescent devices". . p. 4818 - 4826. Retrieved 2020.
• 2、 Xiao, Fuhong,Liao, Yunfeng,Wu, Mingyue,Deng, Guo-Jun. "One-pot synthesis of carbazoles from cyclohexanones and arylhydrazine hydrochlorides under metal-free conditions". . p. 3277 - 3280. Retrieved 2012.
• 3、 -. "COMPOUND FOR ORGANIC OPTOELECTRONIC DEVICE, COMPOSITION FOR ORGANIC OPTOELECTRONIC DEVICE, ORGANIC OPTOELECTRONIC DEVICE, AND DISPLAY DEVICE". Paragraph 0219; 0220-0221. . Retrieved 2021/09/03.