2-Chloroethyl diphenyl phosphate

Base Information

• Chemical Name: 2-Chloroethyl diphenyl phosphate
• CAS No.: 5314-06-7
• Molecular Formula: C14H14ClO4P
• Molecular Weight: 312.69
• DSSTox Substance ID: DTXSID60514330
• Wikidata: Q82374589
• Mol file: 5314-06-7.mol

Synonyms:2-chloroethyl diphenyl phosphate;5314-06-7;SCHEMBL125291;DTXSID60514330;phosphoric acid 2-chloro-ethyl ester diphenyl ester

Chemical Property of 2-Chloroethyl diphenyl phosphate

Chemical Property:

• XLogP3: 3.7
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 7
• Exact Mass: 312.0318236
• Heavy Atom Count: 20
• Complexity: 290

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC=C(C=C1)OP(=O)(OCCCl)OC2=CC=CC=C2

Technology Process of 2-Chloroethyl diphenyl phosphate

There total 4 articles about 2-Chloroethyl diphenyl phosphate 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: 59.0%

[1,3]-dioxolan-2-one (96-49-1) + chlorophosphoric acid diphenyl ester (2524-64-3) → bis(2-chloroethyl) phenyl phosphate (22564-57-4) + phosphoric acid triphenyl ester (115-86-6) + 2-chloroethyl diphenyl phosphate (5314-06-7)

Guidance literature:

With guanidine hydrogen carbonate; at 120 ℃; for 3h;

DOI:10.1080/714040962

Reference yield:

oxirane (75-21-8,99932-75-9) + chlorophosphoric acid diphenyl ester (2524-64-3) → 2-chloroethyl diphenyl phosphate (5314-06-7)

Guidance literature:

With titanium tetrachloride;

Reference yield:

chlorophosphoric acid diphenyl ester (2524-64-3) + 2-chloro-ethanol (107-07-3) → 2-chloroethyl diphenyl phosphate (5314-06-7)

Guidance literature:

With pyridine; benzene;

upstream raw materials:

oxirane

chlorophosphoric acid diphenyl ester

2-chloro-ethanol

[1,3]-dioxolan-2-one