2,2-Dimethylpropyl phenyl methylphosphonate

Base Information

• Chemical Name: 2,2-Dimethylpropyl phenyl methylphosphonate
• CAS No.: 88065-74-1
• Molecular Formula: C12H19O3P
• Molecular Weight: 242.255
• DSSTox Substance ID: DTXSID60522132
• Mol file: 88065-74-1.mol

Synonyms:88065-74-1;2,2-Dimethylpropyl phenyl methylphosphonate;DTXSID60522132

Chemical Property of 2,2-Dimethylpropyl phenyl methylphosphonate

Chemical Property:

• XLogP3: 3
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 5
• Exact Mass: 242.10718146
• Heavy Atom Count: 16
• Complexity: 252

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: CC(C)(C)COP(=O)(C)OC1=CC=CC=C1

Technology Process of 2,2-Dimethylpropyl phenyl methylphosphonate

There total 7 articles about 2,2-Dimethylpropyl phenyl methylphosphonate 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: 52.0%

neopentyl diphenyl phosphite (80705-49-3) → dineopentyl methylphosphonate (53803-21-7) + Methyl-phosphonic acid 2,2-dimethyl-propyl ester phenyl ester (88065-74-1) + dineopentyl phenyl phosphite (80733-03-5)

Guidance literature:

With methyl iodide; In neat (no solvent); at 33 ℃; for 96h; Title compound not separated from byproducts;

DOI:10.1039/P29830001363

Reference yield: 52.0%

neopentyl diphenyl phosphite (80705-49-3) + methyl iodide (74-88-4) → dineopentyl methylphosphonate (53803-21-7) + Methyl-phosphonic acid 2,2-dimethyl-propyl ester phenyl ester (88065-74-1) + dineopentyl phenyl phosphite (80733-03-5)

Guidance literature:

In neat (no solvent); at 33 ℃; for 96h; Title compound not separated from byproducts;

DOI:10.1039/P29830001363

Reference yield:

dineopentyl phenyl phosphite (80733-03-5) → triphenyl phosphite (101-02-0) + diphenyl methylphosphonate (7526-26-3) + Methyl-phosphonic acid 2,2-dimethyl-propyl ester phenyl ester (88065-74-1) + neopentyl diphenyl phosphite (80705-49-3)

Guidance literature:

With methyl iodide; In neat (no solvent); at 33 ℃; for 1080h; Title compound not separated from byproducts;

DOI:10.1039/P29830001363

upstream raw materials:

dineopentyl phenyl phosphite

neopentyl diphenyl phosphite

methyl iodide

2,2-dimethyl-propanol-1