2-(4,6-Diphenyl-1,3,5-triazin-2-yl)phenol

Base Information

• Chemical Name: 2-(4,6-Diphenyl-1,3,5-triazin-2-yl)phenol
• CAS No.: 3202-86-6
• Molecular Formula: C21H15 N3 O
• Molecular Weight: 325.37
• DSSTox Substance ID: DTXSID301273255
• Nikkaji Number: J693.674A
• Mol file: 3202-86-6.mol

Synonyms:2-(4,6-Diphenyl-1,3,5-triazin-2-yl)phenol;3202-86-6;2-(2-Hydroxyphenyl)-4,6-diphenyl-1,3,5-triazine;Oprea1_023678;SCHEMBL296255;SCHEMBL15477958;DTXSID301273255;CCG-15550;AKOS001603374;2,4-diphenyl-6-(2'-hydroxyphenyl)-s-triazine;o-(4,6-Diphenyl-1,3,5-triazin-2-yl)phenol;2-(4,6-Diphenyl-1,3,5-triazin-2-yl)phenol #

Chemical Property of 2-(4,6-Diphenyl-1,3,5-triazin-2-yl)phenol

Chemical Property:

• Vapor Pressure: 4.62E-10mmHg at 25°C
• Boiling Point: 498.2°C at 760 mmHg
• Flash Point: 255.1°C
• Density: 1.21g/cm³
• XLogP3: 4.6
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 3
• Exact Mass: 325.121512110
• Heavy Atom Count: 25
• Complexity: 380

Purity/Quality:

95%, 99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC=C(C=C1)C2=NC(=NC(=N2)C3=CC=CC=C3O)C4=CC=CC=C4

Technology Process of 2-(4,6-Diphenyl-1,3,5-triazin-2-yl)phenol

There total 6 articles about 2-(4,6-Diphenyl-1,3,5-triazin-2-yl)phenol 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: 76.0%

benzamidine monohydrochloride (1670-14-0) + 2-Hydroxyphenylacetic acid (614-75-5) → 2-(2-Hydroxyphenyl)-4,6-diphenyl-1,3,5-triazine (3202-86-6)

Guidance literature:

With potassium carbonate; In N,N-dimethyl-formamide; at 120 ℃;

DOI:10.1002/ejoc.201800178

Reference yield: 54.0%

benzamidine monohydrochloride (1670-14-0) + salicylaldehyde (90-02-8) → 2-(2-Hydroxyphenyl)-4,6-diphenyl-1,3,5-triazine (3202-86-6)

Guidance literature:

With copper(II) acetate monohydrate; sodium carbonate; In toluene; at 100 ℃; for 24h;

DOI:10.1007/s10895-018-2235-2

Reference yield:

benzamidin (618-39-3) + 2-hydroxy-benzoic acid ethyl ester (118-61-6) → 2-(2-Hydroxyphenyl)-4,6-diphenyl-1,3,5-triazine (3202-86-6)

Guidance literature:

With diethyl ether; ethanol; at 40 ℃;

upstream raw materials:

N-salicyloyl-benzamidine

benzamidin

2-hydroxy-benzoic acid ethyl ester

benzamidine monohydrochloride

Downstream raw materials:

benzamide

benzoic acid

phenol

Refernces

• 1、 Wang, Xueding,Xu, Yilian,Yang, Lu,Lu, Xiang,Zou, Hao,Yang, Weiqing,Zhang, Yuanyuan,Li, Zicheng,Ma, Menglin. "Synthesis, Spectra, and Theoretical Investigations of 1,3,5-Triazines Compounds as Ultraviolet Rays Absorber Based on Time-Dependent Density Functional Calculations and three-Dimensional Quantitative Structure-Property Relationship". . p. 707 - 723. Retrieved 2018/05/05.