3-[(Diethoxyphosphinyl)methoxymethyl]phenyl 2,2-dimethylpropanoate

Base Information

Chemical Name:3-[(Diethoxyphosphinyl)methoxymethyl]phenyl 2,2-dimethylpropanoate
CAS No.:134518-90-4
Molecular Formula:C17H27O6P
Molecular Weight:358.372
Hs Code.:
DSSTox Substance ID:DTXSID001166550
Nikkaji Number:J2.335.660K

Synonyms:SCHEMBL8582000;DTXSID001166550;[alpha-Methoxy-3-(pivaloyloxy)benzyl]phosphonic acid diethyl ester;3-[(Diethoxyphosphinyl)methoxymethyl]phenyl 2,2-dimethylpropanoate;134518-90-4

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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 3-[(Diethoxyphosphinyl)methoxymethyl]phenyl 2,2-dimethylpropanoate

Chemical Property:

XLogP3:2.8
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:10
Exact Mass:358.15452557
Heavy Atom Count:24
Complexity:435

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:

Useful:

Canonical SMILES:CCOP(=O)(C(C1=CC(=CC=C1)OC(=O)C(C)(C)C)OC)OCC

Technology Process of 3-[(Diethoxyphosphinyl)methoxymethyl]phenyl 2,2-dimethylpropanoate

There total 4 articles about 3-[(Diethoxyphosphinyl)methoxymethyl]phenyl 2,2-dimethylpropanoate 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: 83.0%

: 134519-01-0
3-(dimethoxymethyl)phenyl pivalate

: 122-52-1
triethyl phosphite

: 134518-90-4
3-[(diethoxyphosphoryl)(methoxy)methyl]phenyl pivalate

Guidance literature:: 3-(dimethoxymethyl)phenyl pivalate; triethyl phosphite; In dichloromethane; at 25 ℃; for 5h;

With boron trifluoride diethyl etherate; In dichloromethane; at -55 - 5 ℃; Further stages.;
DOI:10.1055/s-2006-942357

Reference yield:

: 3282-30-2
pivaloyl chloride

: 134518-90-4
3-[(diethoxyphosphoryl)(methoxy)methyl]phenyl pivalate

Guidance literature:: Multi-step reaction with 3 steps

1.1: 90 percent / Et₃N / CH₂Cl₂ / 2 h / 20 °C

2.1: 89 percent / p-TsOH / methanol / 14 h

3.1: CH₂Cl₂ / 5 h / 25 °C

3.2: 83 percent / BF₃*OEt₂ / CH₂Cl₂ / -55 - 5 °C

With toluene-4-sulfonic acid; triethylamine; In methanol; dichloromethane;
DOI:10.1055/s-2006-942357

Reference yield:

: 100-83-4
meta-hydroxybenzaldehyde

: 134518-90-4
3-[(diethoxyphosphoryl)(methoxy)methyl]phenyl pivalate

Guidance literature:: Multi-step reaction with 3 steps

1.1: 90 percent / Et₃N / CH₂Cl₂ / 2 h / 20 °C

2.1: 89 percent / p-TsOH / methanol / 14 h

3.1: CH₂Cl₂ / 5 h / 25 °C

3.2: 83 percent / BF₃*OEt₂ / CH₂Cl₂ / -55 - 5 °C

With toluene-4-sulfonic acid; triethylamine; In methanol; dichloromethane;
DOI:10.1055/s-2006-942357