Dimethyl (4-hydroxy-1-phenylbutyl)phosphonate

Base Information

Chemical Name:Dimethyl (4-hydroxy-1-phenylbutyl)phosphonate
CAS No.:137333-78-9
Molecular Formula:C12H19O4P
Molecular Weight:258.254
Hs Code.:
DSSTox Substance ID:DTXSID10568323

Synonyms:137333-78-9;Dimethyl (4-hydroxy-1-phenylbutyl)phosphonate;DTXSID10568323

Suppliers and Price of Dimethyl (4-hydroxy-1-phenylbutyl)phosphonate

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
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price

Total 1 raw suppliers

Chemical Property of Dimethyl (4-hydroxy-1-phenylbutyl)phosphonate

Chemical Property:

XLogP3:1
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:7
Exact Mass:258.10209608
Heavy Atom Count:17
Complexity:243

Purity/Quality:: 99.90% ^*data from raw suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

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

Technology Process of Dimethyl (4-hydroxy-1-phenylbutyl)phosphonate

There total 5 articles about Dimethyl (4-hydroxy-1-phenylbutyl)phosphonate 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: 84.0%

: 137333-77-8
dimethyl <1-phenyl-4-<(tert-butyldimethylsilyl)oxy>butyl>phosphonate

: 137333-78-9
dimethyl (1-phenyl-4-hydroxybutyl)phosphonate

Guidance literature:: With tetrabutyl ammonium fluoride; In tetrahydrofuran; for 4h; Ambient temperature;
DOI:10.1021/jo00026a008

Reference yield:

: 4850-50-4
1-phenyl-butane-1,4-diol

: 137333-78-9
dimethyl (1-phenyl-4-hydroxybutyl)phosphonate

Guidance literature:: Multi-step reaction with 4 steps

1: 96 percent / pyridine / 1) 0 deg C to rt, 2 h, 2) rt, 18 h

2: 99 percent / tetrazole / acetonitrile / 6 h / Ambient temperature

3: 72 percent / benzene / 8 h / Irradiation

4: 84 percent / Bu₄NF / tetrahydrofuran / 4 h / Ambient temperature

With pyridine; 1H-tetrazole; tetrabutyl ammonium fluoride; In tetrahydrofuran; acetonitrile; benzene;
DOI:10.1021/jo00026a008

Reference yield:

: 137333-75-6
4-tert-butyldimethylsilyloxy-1-phenylbutan-1-ol

: 137333-78-9
dimethyl (1-phenyl-4-hydroxybutyl)phosphonate

Guidance literature:: Multi-step reaction with 3 steps

1: 99 percent / tetrazole / acetonitrile / 6 h / Ambient temperature

2: 72 percent / benzene / 8 h / Irradiation

3: 84 percent / Bu₄NF / tetrahydrofuran / 4 h / Ambient temperature

With 1H-tetrazole; tetrabutyl ammonium fluoride; In tetrahydrofuran; acetonitrile; benzene;
DOI:10.1021/jo00026a008