Phosphoric acid, (R)-cyanophenylmethyl diethyl ester

Base Information

Chemical Name:Phosphoric acid, (R)-cyanophenylmethyl diethyl ester
CAS No.:604808-44-8
Molecular Formula:C12H16NO4P
Molecular Weight:269.237
Hs Code.:
DSSTox Substance ID:DTXSID90467345
Nikkaji Number:J1.936.031H
Wikidata:Q82294272

Synonyms:Phosphoric acid, (R)-cyanophenylmethyl diethyl ester;604808-44-8;DTXSID90467345

Suppliers and Price of Phosphoric acid, (R)-cyanophenylmethyl diethyl ester

Supply Marketing:

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

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Chemical Property of Phosphoric acid, (R)-cyanophenylmethyl diethyl ester

Chemical Property:

XLogP3:1.7
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:7
Exact Mass:269.08169499
Heavy Atom Count:18
Complexity:322

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CCOP(=O)(OCC)OC(C#N)C1=CC=CC=C1
Isomeric SMILES:CCOP(=O)(OCC)O[C@@H](C#N)C1=CC=CC=C1

Technology Process of Phosphoric acid, (R)-cyanophenylmethyl diethyl ester

There total 7 articles about Phosphoric acid, (R)-cyanophenylmethyl diethyl 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: 89.0%

: 2942-58-7
diethyl cyanophosphonate

: 100-52-7
benzaldehyde

: 604808-44-8
(R)-2-(diethylphosphoryloxy)-2-phenylacetonitrile

Guidance literature:: (S)-1,1'-di(2-hydroxy-3-((diethylamino)methyl)naphthyl)*AlCl; In hexane; toluene; at 20 ℃; for 4h;
DOI:10.1002/anie.200351552

Reference yield: 11.0%

: 2942-58-7
diethyl cyanophosphonate

: 100-52-7
benzaldehyde

: 532-28-5,613-88-7
(RS)-mandelonitrile

: 604808-44-8
(R)-2-(diethylphosphoryloxy)-2-phenylacetonitrile

: (S)-2-(diethylphosphoryloxy)-2-phenylacetonitrile

Guidance literature:: With n-butyllithium; tris(2,6-dimethyoxyphenyl)phosphine oxide; chiral tris(binaphthoxide)-based yttrium; In tetrahydrofuran; hexane; water; at -78 ℃; for 2h; Title compound not separated from byproducts;
DOI:10.1016/j.tetasy.2005.12.038

Reference yield:

: 10020-96-9
(R)-Mandelonitrile

: 814-49-3
diethyl chlorophosphate

: 604808-44-8
(R)-2-(diethylphosphoryloxy)-2-phenylacetonitrile

: (S)-2-(diethylphosphoryloxy)-2-phenylacetonitrile

Guidance literature:: With 1-methyl-1H-imidazole; In tetrahydrofuran; at 20 ℃; for 3h; Title compound not separated from byproducts;
DOI:10.1002/chem.200401290