1-(1,1-Dimethylethyl) (2R,4R)-4-(4-chlorophenoxy)-1,2-pyrrolidinedicarboxylate

Base Information

Chemical Name:1-(1,1-Dimethylethyl) (2R,4R)-4-(4-chlorophenoxy)-1,2-pyrrolidinedicarboxylate
CAS No.:198969-29-8
Molecular Formula:C₁₆H₂₀ClNO₅
Molecular Weight:341.791
Hs Code.:
DSSTox Substance ID:DTXSID801137359

Synonyms:DTXSID801137359;1-(1,1-Dimethylethyl) (2R,4R)-4-(4-chlorophenoxy)-1,2-pyrrolidinedicarboxylate;198969-29-8

Suppliers and Price of 1-(1,1-Dimethylethyl) (2R,4R)-4-(4-chlorophenoxy)-1,2-pyrrolidinedicarboxylate

Supply Marketing:

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

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Chemical Property of 1-(1,1-Dimethylethyl) (2R,4R)-4-(4-chlorophenoxy)-1,2-pyrrolidinedicarboxylate

Chemical Property:

XLogP3:3.2
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:5
Exact Mass:341.1030004
Heavy Atom Count:23
Complexity:442

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:

Useful:

Canonical SMILES:CC(C)(C)OC(=O)N1CC(CC1C(=O)O)OC2=CC=C(C=C2)Cl
Isomeric SMILES:CC(C)(C)OC(=O)N1C[C@@H](C[C@@H]1C(=O)O)OC2=CC=C(C=C2)Cl

Technology Process of 1-(1,1-Dimethylethyl) (2R,4R)-4-(4-chlorophenoxy)-1,2-pyrrolidinedicarboxylate

There total 3 articles about 1-(1,1-Dimethylethyl) (2R,4R)-4-(4-chlorophenoxy)-1,2-pyrrolidinedicarboxylate 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: 90.0%

: 198969-21-0
(2R,4R)-4-(4-Chloro-phenoxy)-pyrrolidine-1,2-dicarboxylic acid 1-tert-butyl ester 2-methyl ester

: 198969-29-8
(2R,4R)-4-(4-Chloro-phenoxy)-pyrrolidine-1,2-dicarboxylic acid 1-tert-butyl ester

Guidance literature:: With sodium hydroxide; In 1,4-dioxane; for 5h; Ambient temperature;
DOI:10.1021/jm970439a

Reference yield:

: 135042-17-0
(2R,4S)-1-tert-butyl 2-methyl 4-hydroxypyrrolidine-1,2-dicarboxylate

: 198969-29-8
(2R,4R)-4-(4-Chloro-phenoxy)-pyrrolidine-1,2-dicarboxylic acid 1-tert-butyl ester

Guidance literature:: Multi-step reaction with 2 steps

1: 78 percent / PPh₃, DEAD / tetrahydrofuran / Ambient temperature

2: 90 percent / 1N aq. NaOH / dioxane / 5 h / Ambient temperature

With sodium hydroxide; triphenylphosphine; diethylazodicarboxylate; In tetrahydrofuran; 1,4-dioxane;
DOI:10.1021/jm970439a

Reference yield:

: 106-48-9,82344-39-6
4-chloro-phenol

: 198969-29-8
(2R,4R)-4-(4-Chloro-phenoxy)-pyrrolidine-1,2-dicarboxylic acid 1-tert-butyl ester

Guidance literature:: Multi-step reaction with 2 steps

1: 78 percent / PPh₃, DEAD / tetrahydrofuran / Ambient temperature

2: 90 percent / 1N aq. NaOH / dioxane / 5 h / Ambient temperature

With sodium hydroxide; triphenylphosphine; diethylazodicarboxylate; In tetrahydrofuran; 1,4-dioxane;
DOI:10.1021/jm970439a