Hexaphenyl cyclotriphosphazene

Base Information

• Chemical Name: Hexaphenyl cyclotriphosphazene
• CAS No.: 1110-78-7
• Molecular Formula: C36H30N3P3
• Molecular Weight: 597.576
• NSC Number: 139815
• DSSTox Substance ID: DTXSID00300890
• Nikkaji Number: J1.332.145K
• Wikidata: Q72482243
• Mol file: 1110-78-7.mol

Synonyms:Hexaphenyl cyclotriphosphazene;1110-78-7;2,2,4,4,6,6-hexakis-phenyl-1,3,5-triaza-2lambda5,4lambda5,6lambda5-triphosphacyclohexa-1,3,5-triene;2,2,4,4,6,6-Hexahydro-2,2,4,4,6,6-hexaphenyl-1,3,5,2,4,6-triazatriphosphorine;NSC139815;hexaphenylcyclotriphosphazatriene;SCHEMBL12417340;DTXSID00300890;NSC-139815;1,5,2,4,6-Triazatriphosphorine, 2,2,4,4,6,6-hexahydro-2,2,4,4,6,6-hexaphenyl- (VAN8C

Chemical Property of Hexaphenyl cyclotriphosphazene

Chemical Property:

• Melting Point: 228 °C
• Refractive Index: 1.662
• PKA: -4.56±0.27(Predicted)
• PSA: 66.51000
• Density: 1.22 g/cm³
• LogP: 6.60840
• XLogP3: 9.9
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 6
• Exact Mass: 597.16525896
• Heavy Atom Count: 42
• Complexity: 806

Purity/Quality:

98%,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)P2(=NP(=NP(=N2)(C3=CC=CC=C3)C4=CC=CC=C4)(C5=CC=CC=C5)C6=CC=CC=C6)C7=CC=CC=C7

Technology Process of Hexaphenyl cyclotriphosphazene

There total 13 articles about Hexaphenyl cyclotriphosphazene 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: 77.0%

diphenylphosphinamide (5994-87-6) → hexaphenyl-cyclotriphosphazene (1110-78-7)

Guidance literature:

With triethylamine; triphenylphosphine; In tetrachloromethane; dichloromethane; at 45 ℃; for 5h;

DOI:10.1016/j.polymer.2021.123491

Reference yield: 76.24%

phenol (108-95-2,27073-41-2) → hexaphenyl-cyclotriphosphazene (1110-78-7)

Guidance literature:

phenol; With tetrabutylammomium bromide; sodium hydroxide; In chlorobenzene; at 50 ℃; for 0.5h;

With 2,2,4,4,6,6-hexachloro-1,3,5-triaza-2,4,6-triphosphorine; In chlorobenzene; at 50 - 110 ℃; for 24.5h;

Reference yield: 63.0%

(1Z,6Z)-2,2,4,4-Tetraphenyl-6,8-bis-[1,2,2,2-tetrafluoro-1-(1,1,2,3,3,3-hexafluoro-2-heptafluoropropyloxy-propoxy)-ethyl]-2λ5,4λ5-[1,3,5,7,2,4]tetrazadiphosphocine → 2,2-diphenyl-4,6-bis-[1,2,2,2-tetrafluoro-1-(1,1,2,3,3,3-hexafluoro-2-heptafluoropropoxy-propoxy)-ethyl]-2λ5-[1,3,5,2]triazaphosphinine (65288-70-2) + Perfluoro-2,5-dimethyl-3,6-dioxanonanonitril (57697-79-7) + 1,1,1,2,2,3,3,5,6,6,8,9,9,9-Tetradecafluoro-4,7-dioxa-5-(trifluoromethyl)-nonane (3330-14-1) + hexaphenyl-cyclotriphosphazene (1110-78-7) + benzene (71-43-2,26181-88-4,54682-86-9,13967-78-7,174973-66-1)

Guidance literature:

With air; at 316 ℃; for 24h; Product distribution; various temp.; effect of oxigen;

DOI:10.1016/S0022-1139(00)82366-0

upstream raw materials:

diphenyltrichlorophosphorane

diphenylphosphinamide

diphenylphosphinic acid hydrazide

2-Diphenylphosphanyl-5-phenyl-2H-tetrazole

Downstream raw materials:

N3P3(C6H5)5{(η6-C6H5)Cr(CO)3}

diphenyl-phosphinic acid