2,9-Bis(2,6-dimethylphenyl)-1,10-phenanthroline

Base Information

• Chemical Name: 2,9-Bis(2,6-dimethylphenyl)-1,10-phenanthroline
• CAS No.: 124318-71-4
• Molecular Formula: C28H24N2
• Molecular Weight: 388.512
• DSSTox Substance ID: DTXSID60565928
• Nikkaji Number: J842.899I
• Wikidata: Q82451275
• Mol file: 124318-71-4.mol

Synonyms:2,9-BIS(2,6-DIMETHYLPHENYL)-1,10-PHENANTHROLINE;124318-71-4;SCHEMBL15570417;DTXSID60565928

Chemical Property of 2,9-Bis(2,6-dimethylphenyl)-1,10-phenanthroline

Chemical Property:

• XLogP3: 7.2
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 2
• Exact Mass: 388.193948774
• Heavy Atom Count: 30
• Complexity: 505

Purity/Quality:

85.0-99.8% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=C(C(=CC=C1)C)C2=NC3=C(C=CC4=C3N=C(C=C4)C5=C(C=CC=C5C)C)C=C2

Technology Process of 2,9-Bis(2,6-dimethylphenyl)-1,10-phenanthroline

There total 1 articles about 2,9-Bis(2,6-dimethylphenyl)-1,10-phenanthroline 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:

1,10-Phenanthroline (66-71-7) + 2-Bromo-m-xylene (576-22-7) → 2-(2',6'-dimethylphenyl)-1,10-phenanthroline (124318-72-5) + 2,9-Bis(2',6'-dimethylphenyl)-1,10-phenanthroline (124318-71-4)

Guidance literature:

Yield given. Multistep reaction. Yields of byproduct given;

Reference yield: 86.0%

tetrakis(acetonitrile)copper(I)tetrafluoroborate + 2,9-Bis(2',6'-dimethylphenyl)-1,10-phenanthroline (124318-71-4) + 4,7-bis(phenylethinyl)-1,10-phenanthroline (192226-55-4) → (CH3)2C6H3C12N2H6C6H3(CH3)2CuC6H5CCC12N2H6CCC6H5(1+)*BF4(1-)=(CH3)2C6H3C12N2H6C6H3(CH3)2CuC12N2H6(CCC6H5)2BF4 (192226-41-8)

Guidance literature:

In not given;

DOI:10.1039/a701509g

Reference yield:

sodium tetrahydroborate (16940-66-2) + tetrakis(actonitrile)copper(I) hexafluorophosphate (64443-05-6) + 1,3,5-trimethyl-2,4,6-tris(4-pyridinylethynyl)benzene (890660-91-0) + 2,9-dimesityl-[1,10]-phenanthroline (192226-54-3) + 2,9-Bis(2',6'-dimethylphenyl)-1,10-phenanthroline (124318-71-4) + 1,2-dichloro-benzene (95-50-1) + 2P(C6H5)4(1+)*Fe4C(2-)*12CO=[P(C6H5)4]2[Fe4C(CO)12] + N,N-bis(diphenylphosphino)-3,4-dimethoxyaniline (1224741-75-6) + [Et4N]2[Fe6C(CO)16] → [Cu6(2,9-dimesityl-1,10-phenanthroline)6(1,3,5-trimethyl-2,4,6-tris(4-pyridinylethynyl)benzene)4(PF6)6]*2(dichloromethane) + [Cu(C12H6N2(C6H3(CH3)2)2)(4,4'-bipyridine)(PF6)]*(1,2-dichlorobenzene) (1185907-11-2)

Guidance literature:

In toluene; acetonitrile; Zn complex in toluene layered with toluene, acetonitrile and Cu complex in acetonitrile for 36 h; elem. anal.;

DOI:10.1002/ejic.201000903

upstream raw materials:

1,10-Phenanthroline

2-Bromo-m-xylene

Downstream raw materials:

(CH₃)2C₆H₃C₁₂N₂H₆C₆H₃(CH₃)2CuC₆H₅CCC₁₂N₂H₆CCC₆H₅⁽¹⁺⁾*BF₄^(1-)=(CH₃)2C₆H₃C₁₂N₂H₆C₆H₃(CH₃)2CuC₁₂N₂H₆(CCC₆H₅)2BF₄

[Cu(C₁₂H₆N₂(C₆H₃(CH₃)2)2)(4,4'-bipyridine)(PF₆)]*(1,2-dichlorobenzene)