2,5-Diphenylpyrimidine

Base Information

• Chemical Name: 2,5-Diphenylpyrimidine
• CAS No.: 29134-16-5
• Molecular Formula: C16H12N2
• Molecular Weight: 232.285
• DSSTox Substance ID: DTXSID90353835
• Nikkaji Number: J873.438K
• Wikidata: Q82131646
• ChEMBL ID: CHEMBL1494181
• Mol file: 29134-16-5.mol

Synonyms:2,5-diphenylpyrimidine;29134-16-5;Pyrimidine, 2,5-diphenyl-;MLS000532078;SMR000137020;2,5-diphenyl-pyrimidine;Maybridge3_000563;Cambridge id 5339886;cid_755305;SCHEMBL2117282;CHEMBL1494181;BDBM48260;DTXSID90353835;HEYRZXKTUUUXKL-UHFFFAOYSA-N;HMS1432J13;HMS2506P06;CCG-48398;IDI1_011950;SR-01000637944-1

Chemical Property of 2,5-Diphenylpyrimidine

Chemical Property:

• PSA: 25.78000
• LogP: 3.81060
• XLogP3: 3.5
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 2
• Exact Mass: 232.100048391
• Heavy Atom Count: 18
• Complexity: 234

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC=C(C=C1)C2=CN=C(N=C2)C3=CC=CC=C3

Technology Process of 2,5-Diphenylpyrimidine

There total 22 articles about 2,5-Diphenylpyrimidine 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%

5-phenyl-1,2,3-triazine (106636-96-8) + benzamidin (618-39-3) → 2,5-diphenylpyrimidine (29134-16-5)

Guidance literature:

In 1,4-dioxane; at 22 ℃; for 6h; regioselective reaction;

DOI:10.1021/ja204856a

Reference yield: 86.0%

benzamidine monohydrochloride (1670-14-0) + ((E)-3-Dimethylamino-2-phenyl-allylidene)-dimethyl-ammonium; perchlorate (7089-34-1) → 2,5-diphenylpyrimidine (29134-16-5)

Guidance literature:

With pyridine; for 12h; Heating;

DOI:10.1055/s-1997-1405

Reference yield: 81.0%

5-Bromo-2-chloropyrimidine (32779-36-5) + phenylboronic acid (98-80-6) → 2,5-diphenylpyrimidine (29134-16-5)

Guidance literature:

With bis-triphenylphosphine-palladium(II) chloride; sodium carbonate; In 1,4-dioxane; at 90 ℃;

DOI:10.1002/ejoc.201000631

upstream raw materials:

benzamidine monohydrochloride

cis-2,3-Dihydro-2,3,6-triphenyl-1H-1,4-diazepin

1-(n-pentyl)-4-phenylpiperazine

((E)-3-Dimethylamino-2-phenyl-allylidene)-dimethyl-ammonium; perchlorate

Downstream raw materials:

2-(2-chlorophenyl)-5-phenylpyrimidine

2-(5-phenylpyrimidin-2-yl)phenyl acetate

2-(2,6-dichlorophenyl)-5-phenylpyrimidine