(S)-tert-Butyl 4-(1-(benzylthio)-2-hydroxy-3-((methylsulfonyl)oxy)propan-2-yl)piperidine-1-carboxylate

Base Information

Chemical Name:(S)-tert-Butyl 4-(1-(benzylthio)-2-hydroxy-3-((methylsulfonyl)oxy)propan-2-yl)piperidine-1-carboxylate
CAS No.:158469-74-0
Molecular Formula:C₂₁H₃₃NO₆S₂
Molecular Weight:459.628
Hs Code.:
DSSTox Substance ID:DTXSID50576205
Wikidata:Q82465773
Mol file:158469-74-0.mol

Synonyms:158469-74-0;(S)-tert-Butyl 4-(1-(benzylthio)-2-hydroxy-3-((methylsulfonyl)oxy)propan-2-yl)piperidine-1-carboxylate;DTXSID50576205;A906486;(S)-tert-Butyl4-(1-(benzylthio)-2-hydroxy-3-((methylsulfonyl)oxy)propan-2-yl)piperidine-1-carboxylate;tert-butyl 4-[(2S)-1-benzylsulfanyl-2-hydroxy-3-methylsulfonyloxypropan-2-yl]piperidine-1-carboxylate;tert-Butyl 4-{(2S)-1-(benzylsulfanyl)-2-hydroxy-3-[(methanesulfonyl)oxy]propan-2-yl}piperidine-1-carboxylate

Suppliers and Price of (S)-tert-Butyl 4-(1-(benzylthio)-2-hydroxy-3-((methylsulfonyl)oxy)propan-2-yl)piperidine-1-carboxylate

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
Packaging
price

Total 8 raw suppliers

Chemical Property of (S)-tert-Butyl 4-(1-(benzylthio)-2-hydroxy-3-((methylsulfonyl)oxy)propan-2-yl)piperidine-1-carboxylate

Chemical Property:

XLogP3:2.6
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:10
Exact Mass:459.17493012
Heavy Atom Count:30
Complexity:643

Purity/Quality:: 97% ^*data from raw suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:

Useful:

Canonical SMILES:CC(C)(C)OC(=O)N1CCC(CC1)C(COS(=O)(=O)C)(CSCC2=CC=CC=C2)O
Isomeric SMILES:CC(C)(C)OC(=O)N1CCC(CC1)[C@](COS(=O)(=O)C)(CSCC2=CC=CC=C2)O

Technology Process of (S)-tert-Butyl 4-(1-(benzylthio)-2-hydroxy-3-((methylsulfonyl)oxy)propan-2-yl)piperidine-1-carboxylate

There total 7 articles about (S)-tert-Butyl 4-(1-(benzylthio)-2-hydroxy-3-((methylsulfonyl)oxy)propan-2-yl)piperidine-1-carboxylate 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: 99.0%

: 124-63-0
methanesulfonyl chloride

: 158469-73-9
4-<(S)-2-benzylthio-1-hydroxy-1-hydroxymethylethyl>-1-piperidinecarboxylic acid (1,1-dimethylethyl) ester

: 158469-74-0
4-<(S)-2-benzylthio-1-hydroxy-1-<<(methanesulfonyl)oxy>methyl>ethyl>-1-piperidinecarboxylic acid (1,1-dimethylethyl) ester

Guidance literature:: With triethylamine; In dichloromethane; at 0 ℃; for 1h;

Reference yield:

: 24424-99-5
di-tert-butyl dicarbonate

: 158469-74-0
4-<(S)-2-benzylthio-1-hydroxy-1-<<(methanesulfonyl)oxy>methyl>ethyl>-1-piperidinecarboxylic acid (1,1-dimethylethyl) ester

Guidance literature:: Multi-step reaction with 6 steps

1: 97 percent / 10percent aq. NaOH / dioxane / 2 h

2: 1 h / 100 °C

3: n-BuLi / tetrahydrofuran; hexane / 2 h / Ambient temperature

4: molecular sieves 4A, L-(+)-diethyl tartrate, titanium tetraisopropoxide, tert-butylhydroperoxide / CH₂Cl₂; 2,2,4-trimethyl-pentane / -20 °C

5: KOH / ethanol / 4 h / Ambient temperature

6: 99 percent / Et₃N / CH₂Cl₂ / 1 h / 0 °C

With titanium(IV) isopropylate; tert.-butylhydroperoxide; potassium hydroxide; sodium hydroxide; n-butyllithium; diethyl (2R,3R)-tartrate; 4 A molecular sieve; triethylamine; In tetrahydrofuran; 1,4-dioxane; 2,2,4-trimethylpentane; ethanol; hexane; dichloromethane;

Reference yield:

: 158469-71-7
4-<(2-hydroxy-1-methylene)ethyl>-1-piperidinecarboxylic acid(1,1-dimethylethyl) ester

: 158469-74-0
4-<(S)-2-benzylthio-1-hydroxy-1-<<(methanesulfonyl)oxy>methyl>ethyl>-1-piperidinecarboxylic acid (1,1-dimethylethyl) ester

Guidance literature:: Multi-step reaction with 3 steps

1: molecular sieves 4A, L-(+)-diethyl tartrate, titanium tetraisopropoxide, tert-butylhydroperoxide / CH₂Cl₂; 2,2,4-trimethyl-pentane / -20 °C

2: KOH / ethanol / 4 h / Ambient temperature

3: 99 percent / Et₃N / CH₂Cl₂ / 1 h / 0 °C

With titanium(IV) isopropylate; tert.-butylhydroperoxide; potassium hydroxide; diethyl (2R,3R)-tartrate; 4 A molecular sieve; triethylamine; In 2,2,4-trimethylpentane; ethanol; dichloromethane;