Hexakis(2,2,3,3-tetrafluoropropoxy)phosphazene

Base Information

• Chemical Name: Hexakis(2,2,3,3-tetrafluoropropoxy)phosphazene
• CAS No.: 58943-98-9
• Molecular Formula: C18H18F24N3O6P3
• Molecular Weight: 921.23
• Hs Code.: 2934999090
• European Community (EC) Number: 689-865-9
• DSSTox Substance ID: DTXSID90880494
• Wikidata: Q81986838
• Mol file: 58943-98-9.mol

Synonyms:58943-98-9;HEXAKIS(2,2,3,3-TETRAFLUOROPROPOXY)PHOSPHAZENE;Hexakis(1H,1H,3H-perfluoropropoxy)phosphazene;2,2,4,4,6,6-hexakis(2,2,3,3-tetrafluoropropoxy)-1,3,5-triaza-2lambda5,4lambda5,6lambda5-triphosphacyclohexa-1,3,5-triene;1,3,5,2,4,6-Triazatriphosphorine, 2,2,4,4,6,6-hexahydro-2,2,4,4,6,6,-hexakis(2,2,3,3-tetrafluoropropoxy);2,2,4,4,6,6-Hexakis(2,2,3,3-tetrafluoropropoxy)-2lambda5,4lambda5,6lambda5-1,3,5,2,4,6-triazatriphosphorine;SCHEMBL8504768;DTXSID90880494;CHEBI:181134;WAVNXLRSYAMQNY-UHFFFAOYSA-N;MFCD00798140;CS-0454032;Hexakis(1H,1H,3H-tetrafluoropropoxy)phosphazene;Hexakis(3,3,2,2-tetrafluoropropoxy)cyclotriphosphazene;HP-921;CE30;DDA;2,2,4,4,6,6-Hexakis(2,2,3,3-tetrafluoropropoxy)-1,3,5-triazatriphosphine;2,2,4,4,6,6-Hexakis(2,2,3,3-tetrafluoropropoxy)-1,3,5,2lambda5,4lambda5,6lambda5-triazatriphosphinine;2,2,4,4,6,6-hexakis(2,2,3,3-tetraluoropropoxy)-1,3,5-triaza-2lambda5,4lambda5,6lambda5-triphosphacyclohexa-1,3,5-triene

Chemical Property of Hexakis(2,2,3,3-tetrafluoropropoxy)phosphazene

Chemical Property:

• Refractive Index: 1.392
• Boiling Point: 174-176/2mm
• PKA: -9.58±0.50(Predicted)
• PSA: 121.89000
• Density: 1.81g/cm³
• LogP: 9.64740
• Storage Temp.: Hygroscopic, -20°C Freezer, Under inert atmosphere
• Solubility.: Chloroform (Slightly), DMSO (Slightly), Methanol (Slightly)
• XLogP3: 10
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 33
• Rotatable Bond Count: 24
• Exact Mass: 921.0025222
• Heavy Atom Count: 54
• Complexity: 1120

Purity/Quality:

NLT 98% ^*data from raw suppliers

2,2,4,4,6,6-Hexakis(2,2,3,3-tetrafluoropropoxy)-2λ5,4λ5,6λ5-1,3,5,2,4,6-triazatriphosphorine ^*data from reagent suppliers

Safty Information:

• Hazard Codes: Xi

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C(C(C(F)F)(F)F)OP1(=NP(=NP(=N1)(OCC(C(F)F)(F)F)OCC(C(F)F)(F)F)(OCC(C(F)F)(F)F)OCC(C(F)F)(F)F)OCC(C(F)F)(F)F
• Uses: 2,2,4,4,6,6-Hexakis(2,2,3,3-tetrafluoropropoxy)-2λ5,4λ5,6λ5-1,3,5,2,4,6-triazatriphosphorine is a component of Ultramark 1621 which is a useful calibration compound for negative and positive ion fast-atom bombardment (FAB) high-resolution mass spectrometry.

Technology Process of Hexakis(2,2,3,3-tetrafluoropropoxy)phosphazene

There total 2 articles about Hexakis(2,2,3,3-tetrafluoropropoxy)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-tetrafluoropropanol (76-37-9) → hexakis(1H,1H,3H-tetrafluoropropoxy)phosphazine (58943-98-9)

Guidance literature:

With 2,2,4,4,6,6-hexachloro-1,3,5-triaza-2,4,6-triphosphorine; sodium; In tetrahydrofuran;

Reference yield:

sodium 2,2,3,3-tetrafluoropropan-1-olate (41578-54-5) → hexakis(1H,1H,3H-tetrafluoropropoxy)phosphazine (58943-98-9)

Guidance literature:

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

upstream raw materials:

2,2,3,3-tetrafluoropropanol

sodium 2,2,3,3-tetrafluoropropan-1-olate

Refernces