(4-Chlorobenzyl)-phosphonic acid dimethyl ester

Base Information

Chemical Name:(4-Chlorobenzyl)-phosphonic acid dimethyl ester
CAS No.:58358-45-5
Molecular Formula:C9H12ClO3P
Molecular Weight:234.619
Hs Code.:
DSSTox Substance ID:DTXSID40483151
Nikkaji Number:J850.689B
Wikidata:Q82320218

Synonyms:(4-chlorobenzyl)-phosphonic acid dimethyl ester;58358-45-5;SCHEMBL5870639;DTXSID40483151;FTUNFPLOAJZQKS-UHFFFAOYSA-N;(4-chloro-benzyl)-phosphonic acid dimethyl ester

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

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Chemical Property of (4-Chlorobenzyl)-phosphonic acid dimethyl ester

Chemical Property:

PSA：45.34000
LogP:3.32590
XLogP3:1.6
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:4
Exact Mass:234.0212589
Heavy Atom Count:14
Complexity:206

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:

Useful:

Canonical SMILES:COP(=O)(CC1=CC=C(C=C1)Cl)OC

Technology Process of (4-Chlorobenzyl)-phosphonic acid dimethyl ester

There total 7 articles about (4-Chlorobenzyl)-phosphonic acid dimethyl 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: 93.0%

: 622-95-7
4-chlorobenzyl bromide

: 121-45-9
phosphorous acid trimethyl ester

: 58358-45-5
p-Chlorobenzylphosphonsaeuredimethylester

Guidance literature:: at 20 - 80 ℃; for 0.416667h;

Reference yield: 65.0%

: 868-85-9
Dimethyl phosphite

: (4-chlorophenyl)methyl methyl carbonate

: 58358-45-5
p-Chlorobenzylphosphonsaeuredimethylester

Guidance literature:: With bis(η3-allyl-μ-chloropalladium(II)); bis[2-(diphenylphosphino)phenyl] ether; In N,N-dimethyl-formamide; at 100 ℃; for 24h; Inert atmosphere; Sealed tube;
DOI:10.1246/cl.170901