Phosphoric acid, 2,2-dichloroethenyl dipropyl ester

Base Information

• Chemical Name: Phosphoric acid, 2,2-dichloroethenyl dipropyl ester
• CAS No.: 71-98-7
• Molecular Formula: C8H15Cl2O4P
• Molecular Weight: 277.084
• Hs Code.: 2919900090
• DSSTox Substance ID: DTXSID9075169
• Nikkaji Number: J5.249C
• Mol file: 71-98-7.mol

Synonyms:71-98-7;Phosphoric acid, 2,2-dichloroethenyl dipropyl ester;2,2-Dichlorovinyl dipropyl phosphate;Phosphoric acid, 2,2-dichlorovinyl dipropyl ester;BRN 1711752;AI3-20740;2,2-dichloroethenyl dipropyl phosphate;DTXSID9075169;SCHEMBL11696761;di-n-propyl-2,2-dichlorovinyl phosphate;LS-107681

Chemical Property of Phosphoric acid, 2,2-dichloroethenyl dipropyl ester

Chemical Property:

• Vapor Pressure: 0.0222mmHg at 25°C
• Boiling Point: 258.4°Cat760mmHg
• Flash Point: 120.3°C
• PSA: 54.57000
• Density: 1.259g/cm³
• LogP: 4.24080
• XLogP3: 3.2
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 8
• Exact Mass: 276.0085013
• Heavy Atom Count: 15
• Complexity: 229

Purity/Quality:

98%min ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCOP(=O)(OCCC)OC=C(Cl)Cl

Technology Process of Phosphoric acid, 2,2-dichloroethenyl dipropyl ester

There total 8 articles about Phosphoric acid, 2,2-dichloroethenyl dipropyl ester 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:

tri-n-propyl phosphite (923-99-9) + chloral hydrate (302-17-0) → O,O-dipropyl-O-(2,2-dichloroethenyl) phosphate (71-98-7) + chloral propylhemiacetal (23639-53-4) + O,O-dipropyl-(1-hydroxy-2,2,2-trichloroethyl)phosphonate (996-43-0) + di-n-propyl phosphonate (1809-21-8)

Guidance literature:

In hexane; for 10h; Heating;

Reference yield:

O,O-dipropyl-(1-hydroxy-2,2,2-trichloroethyl)phosphonate (996-43-0) → O,O-dipropyl-O-(2,2-dichloroethenyl) phosphate (71-98-7)

Guidance literature:

With sodium hydroxide;

DOI:10.1021/ja01614a019

Reference yield:

tri-n-propyl phosphite (923-99-9) + chloral (75-87-6) → O,O-dipropyl-O-(2,2-dichloroethenyl) phosphate (71-98-7)

Guidance literature:

DOI:10.1021/ja01614a019 DOI:10.1021/ja01615a061

upstream raw materials:

O,O-dipropyl-(1-hydroxy-2,2,2-trichloroethyl)phosphonate

tri-n-propyl phosphite

chloral

phosphoric acid dipropyl ester 1,2,2,2-tetrachloro-ethyl ester

Refernces

• 1、 Grechkin,Grishina. "". . . Retrieved 1974.