2'-Iodo-1,1':3',1''-terphenyl

Base Information

• Chemical Name: 2'-Iodo-1,1':3',1''-terphenyl
• CAS No.: 82777-09-1
• Molecular Formula: C18H13I
• Molecular Weight: 356.206
• Hs Code.: 2903999090
• European Community (EC) Number: 653-683-8
• DSSTox Substance ID: DTXSID10399093
• Nikkaji Number: J786.876F
• Wikidata: Q69757803
• Mol file: 82777-09-1.mol

Synonyms:2'-Iodo-1,1':3',1''-terphenyl;82777-09-1;2-iodo-1,3-diphenylbenzene;2'-IODO-M-TERPHENYL;SCHEMBL2562923;2-Iodo-1,1:3,1-terphenyl;RLZYBGOJAWOQMK-UHFFFAOYSA-;DTXSID10399093;MFCD00185026;AKOS024430156;2'-Iodo-1,1':3',1''-terbenzene;BS-17563;CS-0101724;I1086;T72977;2'-IODO-(1,1',3',1'')TERPHENYL;InChI=1/C18H13I/c19-18-16(14-8-3-1-4-9-14)12-7-13-17(18)15-10-5-2-6-11-15/h1-13H

Chemical Property of 2'-Iodo-1,1':3',1''-terphenyl

Chemical Property:

• Melting Point: 113-116oC
• Boiling Point: 435.1oC at 760 mmHg
• Flash Point: 197.3oC
• PSA: 0.00000
• Density: 1.471g/cm3
• LogP: 5.62520
• Storage Temp.: Keep in dark place,Sealed in dry,Room Temperature
• Sensitive.: Light Sensitive
• XLogP3: 6.7
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 0
• Rotatable Bond Count: 2
• Exact Mass: 356.00620
• Heavy Atom Count: 19
• Complexity: 237

Purity/Quality:

99% ^*data from raw suppliers

2'-Iodo-m-terphenyl ^*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=C(C(=CC=C2)C3=CC=CC=C3)I

Technology Process of 2'-Iodo-1,1':3',1''-terphenyl

There total 15 articles about 2'-Iodo-1,1':3',1''-terphenyl 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: 88.0%

1,3-dichloro-2-iodobenzene (19230-28-5) + phenylmagnesium bromide (100-58-3) → 2′-iodo-1,1′:3′,1″-terphenyl (82777-09-1)

Guidance literature:

1,3-dichloro-2-iodobenzene; phenylmagnesium bromide; In tetrahydrofuran; for 3h; Reflux; Inert atmosphere;

With iodine; at 20 ℃; for 1h; Inert atmosphere;

Reference yield: 81.0%

1-chloro-2,3-diiodobenzene + phenylboronic acid (98-80-6) → 3-chloro-2-iodo-1,1'-biphenyl + 2′-iodo-1,1′:3′,1″-terphenyl (82777-09-1)

Guidance literature:

With tetrakis(triphenylphosphine) palladium⁽⁰⁾; potassium carbonate; In ethanol; toluene; at 100 ℃; for 12h; regioselective reaction; Inert atmosphere;

DOI:10.1002/ejoc.201500263

Reference yield: 69.0%

1,3-dibromo-2-iodo-benzene (19821-80-8) + phenylmagnesium bromide (100-58-3) → 2′-iodo-1,1′:3′,1″-terphenyl (82777-09-1)

Guidance literature:

In tetrahydrofuran; at 20 ℃; for 3h; Inert atmosphere;

DOI:10.1021/acs.joc.8b00233

upstream raw materials:

1,3-dibromo-2-iodo-benzene

2,6-diphenylaniline

phenyllithium

1,3-Dichlorobenzene

Downstream raw materials:

biphenyl

1,2,3-triphenylbenzene

3',6''-Diphenyl-o-quaterphenyl

1,3-diphenylbenzene

Refernces

• 1、 Bookser, Brett C.,Do, Quyen-Quyen,Sritana-Anant, Yongsak,Baldridge, Kim K.,Siegel, Jay S.. "Synthesis and Acidity of 5-(m-Terphenyl-2′-yl)-1 H-tetrazoles: Evidence for an Enhanced Polar-πEffect Compared to Carboxylic Acids". . p. 3197 - 3203. Retrieved 2021.
• 2、 -. "ORGANIC ELECTROLUMINESCENCE DEVICE AND MONOAMINE COMPOUND FOR ORGANIC ELECTROLUMINESCENCE DEVICE". Paragraph 0098-0100. . Retrieved 2020/06/16.