Dihexoxy(oxo)phosphanium

Base Information

• Chemical Name: Dihexoxy(oxo)phosphanium
• CAS No.: 6151-90-2
• Molecular Formula: C12H27O3P
• Molecular Weight: 250.318
• DSSTox Substance ID: DTXSID90422590
• Mol file: 6151-90-2.mol

Synonyms:dihexoxy(oxo)phosphanium;6151-90-2;SCHEMBL418814;DTXSID90422590

Chemical Property of Dihexoxy(oxo)phosphanium

Chemical Property:

• Vapor Pressure: 0.001mmHg at 25°C
• Boiling Point: 318.456oC at 760 mmHg
• Flash Point: 167.287oC
• PSA: 69.67000
• LogP: 4.83760
• XLogP3: 4.6
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 12
• Exact Mass: 249.16195668
• Heavy Atom Count: 16
• Complexity: 146

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCCCCO[P+](=O)OCCCCCC

Technology Process of Dihexoxy(oxo)phosphanium

There total 2 articles about Dihexoxy(oxo)phosphanium 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: 75.3%

hexan-1-ol (111-27-3) → dihexyl phosphonate (6151-90-2) + 1-bromo-hexane (111-25-1)

Guidance literature:

With phosphorus tribromide; In diethyl ether; at 0 - 25 ℃; for 6h;

DOI:10.1002/cssc.202001551

Reference yield:

hexan-1-ol (111-27-3) → dihexyl phosphonate (6151-90-2) + trihexyl phosphate (2528-39-4) + dihexyl hexylphosphonate (6418-57-1)

Guidance literature:

With phosphorous; tetraethylammonium iodide; Mechanism; Product distribution; electrolysis; var. solvents;

DOI:10.1007/BF00866580

Reference yield: 98.0%

3,3'-(p-phenylenebismethylene)bisoxazolidine (17994-39-7) + dihexyl phosphonate (6151-90-2) → tetrahexyl methylene>>bisphosphonate

Guidance literature:

In benzene; at 50 - 60 ℃; for 2h;

upstream raw materials:

hexan-1-ol

Downstream raw materials:

dihexyl adipate

1-hexyl acetate

n-hexyl propionate

hexyl benzoate

Refernces

• 1、 Romakhin, A. S.,Zaripov, I. M.,Budnikova, Yu. G.,Kargin, Yu. M.,Nikitin, E. V.,et al.. "ELECTROCHEMICALLY INDUCED PROCESSES IN THE FORMATION OF PHOSPHORUS ACID DERIVATIVES. 2. THE ROLE OF POLYMERIZATION PROCESSES IN THE ELECTROSYNTHESIS OF THE ESTERS OF PHOSPHORUS ACIDS FROM WHITE PHOSPHORUS". . p. 1036 - 1040. Retrieved 2007/10/02.