(2-(F-Hexyl)ethyl) dimorpholinophosphoramidate

Base Information

• Chemical Name: (2-(F-Hexyl)ethyl) dimorpholinophosphoramidate
• CAS No.: 134051-89-1
• Molecular Formula: C16H20F13N2O4P
• Molecular Weight: 582.294
• DSSTox Substance ID: DTXSID00158474
• Nikkaji Number: J424.387K
• Wikidata: Q27117989
• Metabolomics Workbench ID: 56025
• Mol file: 134051-89-1.mol

Synonyms:(2-(F-Hexyl)ethyl) dimorpholinophosphoramidate;BRN 4833103;134051-89-1;F6H2DMP;2-(perfluorohexyl)ethyl dimorpholinophosphinate;3,3,4,4,5,5,6,6,7,7,8,8,8-Tridecafluorooctyl di-4-morpholinylphosphinate;Phosphinic acid, di-4-morpholinyl-, 3,3,4,4,5,5,6,6,7,7,8,8,8-tridecafluorooctyl ester;4-[morpholin-4-yl(3,3,4,4,5,5,6,6,7,7,8,8,8-tridecafluorooctoxy)phosphoryl]morpholine;3,3,4,4,5,5,6,6,7,7,8,8,8-tridecafluorooctyl dimorpholin-4-ylphosphinate;Phosphinic acid, di-4-morpholinyl-,3,3,4,4,5,5,6,6,7,7,8,8,8-tridecafluorooctyl ester;CHEBI:38840;C16H20F13N2O4P;DTXSID00158474;MYWNYBRHKQPGRM-UHFFFAOYSA-N;C16-H20-F13-N2-O4-P;LS-106185;Q27117989;2-(Tridecafluorohexyl)ethoxybismorpholinophosphine oxide

Chemical Property of (2-(F-Hexyl)ethyl) dimorpholinophosphoramidate

Chemical Property:

• Vapor Pressure: 4.52E-07mmHg at 25°C
• Boiling Point: 414.2°Cat760mmHg
• Flash Point: 204.3°C
• Density: 1.53g/cm³
• XLogP3: 4
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 19
• Rotatable Bond Count: 10
• Exact Mass: 582.0953102
• Heavy Atom Count: 36
• Complexity: 777

Purity/Quality:

85.0-99.8% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1COCCN1P(=O)(N2CCOCC2)OCCC(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F

Technology Process of (2-(F-Hexyl)ethyl) dimorpholinophosphoramidate

There total 2 articles about (2-(F-Hexyl)ethyl) dimorpholinophosphoramidate 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: 80.0%

morpholine (110-91-8,99108-56-2) + 3,3,4,4,5,5,6,6,7,7,8,8,8-Tridecafluoro-octyl phosphorodichloridate (134052-00-9) → <2-(F-hexyl)-ethyl>dimorpholinophosphoramidate (134051-89-1)

Guidance literature:

With triethylamine; In diethyl ether; at 0 ℃;

DOI:10.1016/0223-5234(91)90151-C

Reference yield:

1H,1H,2H,2H-tridecafluoro-n-octanol (647-42-7) → <2-(F-hexyl)-ethyl>dimorpholinophosphoramidate (134051-89-1)

Guidance literature:

Multi-step reaction with 2 steps

1: 90 percent / Et₃N, POCl₃ / diethyl ether / 1 h / 0 °C

2: 80 percent / Et₃N / diethyl ether / 0 °C

With triethylamine; trichlorophosphate; In diethyl ether;

DOI:10.1016/0223-5234(91)90151-C

upstream raw materials:

morpholine

3,3,4,4,5,5,6,6,7,7,8,8,8-Tridecafluoro-octyl phosphorodichloridate

1H,1H,2H,2H-tridecafluoro-n-octanol