O-methyl phenylphosphonochloridothioate

Base Information

Chemical Name:O-methyl phenylphosphonochloridothioate
CAS No.:20147-96-0
Molecular Formula:C7H8ClOPS
Molecular Weight:206.63
Hs Code.:2931900090
DSSTox Substance ID:DTXSID80942191
Nikkaji Number:J70.236F
Mol file:20147-96-0.mol

Synonyms:O-methyl phenylphosphonochloridothioate;20147-96-0;Phosphonochloridothioic acid, phenyl-, O-methyl ester;SCHEMBL10481946;DTXSID80942191

Suppliers and Price of O-methyl phenylphosphonochloridothioate

Supply Marketing:

Business phase:: The product has achieved commercial mass production^*data from LookChem market partment

Manufacturers and distributors:

Manufacture/Brand
Chemicals and raw materials
Packaging
price

TRC
O-MethylPhenylphosphonochloridothioate
5g
$ 1970.00

Total 3 raw suppliers

Chemical Property of O-methyl phenylphosphonochloridothioate

Chemical Property:

Boiling Point:90 °C(Press: 0.005 Torr)
PSA：51.13000
Density:1.30±0.1 g/cm3(Predicted)
LogP:3.15720
XLogP3:3.5
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:2
Exact Mass:205.9722007
Heavy Atom Count:11
Complexity:168

Purity/Quality:

99% ^*data from raw suppliers

O-MethylPhenylphosphonochloridothioate ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:COP(=S)(C1=CC=CC=C1)Cl
Uses O-Methyl Phenylphosphonochloridothioate is an intermediate in the synthesis of Leptophos (L329655), which is an organophosphorus pesticides which exhibits a stronger endocrine disruption than its (+)form in JEG-3 cell.

Technology Process of O-methyl phenylphosphonochloridothioate

There total 4 articles about O-methyl phenylphosphonochloridothioate 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:

: phenyl-phosphonothioic acid O-methyl ester; compound with trimethyl-amine

: 20147-96-0
O-methyl phenyl phosphonochloridothioate

Guidance literature:: With trichlorophosphate; In toluene; at 40 ℃; for 5h;
DOI:10.1080/00397919808004850

Reference yield:

: 6840-11-5
phenylthiophosphonic acid dimethyl ester

: 20147-96-0
O-methyl phenyl phosphonochloridothioate

Guidance literature:: Multi-step reaction with 2 steps

1: H₂O / 15 h / 50 - 60 °C

2: POCl₃ / toluene / 5 h / 40 °C

With trichlorophosphate; In water; toluene; 1: dealkylation / 2: Chlorination;
DOI:10.1080/00397919808004850