Hexakis(1H,1H-perfluoropropoxy)phosphazene

Base Information

• Chemical Name: Hexakis(1H,1H-perfluoropropoxy)phosphazene
• CAS No.: 429-18-5
• Molecular Formula: C₁₈H₁₂F₃₀N₃O₆P₃
• Molecular Weight: 1029.18
• Hs Code.: 2934999090
• European Community (EC) Number: 817-174-6
• DSSTox Substance ID: DTXSID80379362
• Wikidata: Q82169133
• Mol file: 429-18-5.mol

Synonyms:429-18-5;Hexakis(1H,1H-perfluoropropoxy)phosphazene;2,2,4,4,6,6-hexakis(2,2,3,3,3-pentafluoropropoxy)-1,3,5-triaza-2lambda5,4lambda5,6lambda5-triphosphacyclohexa-1,3,5-triene;HEXAKIS(2,2,3,3,3-PENTAFLUOROPROPOXY)PHOSPHAZINE;SCHEMBL8507113;DTXSID80379362;UFNLQPBQHDVESI-UHFFFAOYSA-N;AKOS025311288;FT-0627014;Hexakis(1H,1H-perfluoropropoxy)phosphazene 97%;Hexakis((perfluoroethyl)methoxy)cyclotriphosphazene;2,2,4,4,6,6-Hexakis(2,2,3,3,3-pentafluoropropoxy)-1,3,5,2lambda~5~,4lambda~5~,6lambda~5~-triazatriphosphinine

Chemical Property of Hexakis(1H,1H-perfluoropropoxy)phosphazene

Chemical Property:

• Melting Point: 14-16°C
• Refractive Index: 1.361
• Boiling Point: 120°C 2,5mm
• PKA: -11.04±0.50(Predicted)
• Flash Point: °C
• PSA: 121.89000
• Density: 1.84g/cm³
• LogP: 11.43060
• XLogP3: 11.6
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 39
• Rotatable Bond Count: 18
• Exact Mass: 1028.9459910
• Heavy Atom Count: 60
• Complexity: 1330

Purity/Quality:

98%Min ^*data from raw suppliers

Hexakis(1H,1H-pentafluoropropoxy)phosphazene 95% ^*data from reagent suppliers

Safty Information:

• Hazard Codes: Xi
• Statements: 20/21/22
• Safety Statements: 23-36/37/39

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C(C(C(F)(F)F)(F)F)OP1(=NP(=NP(=N1)(OCC(C(F)(F)F)(F)F)OCC(C(F)(F)F)(F)F)(OCC(C(F)(F)F)(F)F)OCC(C(F)(F)F)(F)F)OCC(C(F)(F)F)(F)F

Technology Process of Hexakis(1H,1H-perfluoropropoxy)phosphazene

There total 4 articles about Hexakis(1H,1H-perfluoropropoxy)phosphazene 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:

2,2,3,3,3-pentafluoropropyl alcohol (422-05-9) → Hexakis-(2,2,3,3,3-pentafluor-1-propoxy)-cyclotriphosphazen (429-18-5)

Guidance literature:

Multistep reaction; (i) NaH, Et₂O, (ii) (NPCl₂)3, toluene;

DOI:10.1021/ja00756a023

Reference yield:

2,2,3,3,3-pentafluoro-propan-1-ol; sodium salt (37432-08-9) → Hexakis-(2,2,3,3,3-pentafluor-1-propoxy)-cyclotriphosphazen (429-18-5)

Guidance literature:

With 2,2,4,4,6,6-hexachloro-1,3,5-triaza-2,4,6-triphosphorine; In diethyl ether;

Reference yield:

2,2,4,4,6,6-hexachloro-1,3,5-triaza-2,4,6-triphosphorine (940-71-6,16422-79-0) → Hexakis-(2,2,3,3,3-pentafluor-1-propoxy)-cyclotriphosphazen (429-18-5)

Guidance literature:

With toluene;

upstream raw materials:

2,2,3,3,3-pentafluoropropyl alcohol

2,2,3,3,3-pentafluoro-propan-1-ol; sodium salt

2,2,4,4,6,6-hexachloro-1,3,5-triaza-2,4,6-triphosphorine