1-Boc-4-(oxiran-2-ylmethyl)-4-hydroxypiperidine

Base Information

• Chemical Name: 1-Boc-4-(oxiran-2-ylmethyl)-4-hydroxypiperidine
• CAS No.: 203662-52-6
• Molecular Formula: C13H23NO4
• Molecular Weight: 257.33
• DSSTox Substance ID: DTXSID601150173
• Mol file: 203662-52-6.mol

Synonyms:203662-52-6;1-Boc-4-(oxiran-2-ylmethyl)-4-hydroxypiperidine;tert-butyl 4-hydroxy-4-(oxiran-2-ylmethyl)piperidine-1-carboxylate;MFCD24467250;1-Piperidinecarboxylic acid, 4-hydroxy-4-(oxiranylmethyl)-, 1,1-dimethylethyl ester (9CI);4-hydroxy-4-(oxiran-2-ylmethyl)-piperidine-1-carboxylic acid tert-butyl ester;SCHEMBL1224299;UKPQAGHIODTKFO-UHFFFAOYSA-N;DTXSID601150173;4-Hydroxy-4-oxiranylmethyl-piperidine-1-carboxylic acid tert-butyl ester;AKOS025243994;AS-32583;SY029270;DB-263121;CS-0105935;EN300-380310;A879679;Z1508693581;4-(2,3-epoxypropan -1-yl)-1-(tert-butoxycarbonyl)piperidin -4-ol;4-(2,3-Epoxypropan-1-yl)-1-(tert-butoxycarbonyl)piperidin -4-ol;4-(2,3-Epoxypropan-1-yl)-1-(tert-butoxycarbonyl)piperidin-4-ol;tert-butyl4-hydroxy-4-(oxiran-2-ylmethyl)piperidine-1-carboxylate;1,1-Dimethylethyl 4-hydroxy-4-(2-oxiranylmethyl)-1-piperidinecarboxylate;tert-butyl 4-hydroxy-4-[(oxiran-2-yl)methyl]piperidine-1-carboxylate;1-Piperidinecarboxylic acid, 4-hydroxy-4-(2-oxiranylmethyl)-, 1,1-dimethylethyl ester

Chemical Property of 1-Boc-4-(oxiran-2-ylmethyl)-4-hydroxypiperidine

Chemical Property:

• Boiling Point: 364.1±27.0 °C(Predicted)
• PKA: 14.53±0.20(Predicted)
• PSA: 62.30000
• Density: 1.180±0.06 g/cm3(Predicted)
• LogP: 1.47520
• XLogP3: 0.8
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 4
• Exact Mass: 257.16270821
• Heavy Atom Count: 18
• Complexity: 315

Purity/Quality:

97% ^*data from raw suppliers

1-BOC-4-(OXIRAN-2-YLMETHYL)-4-HYDROXYPIPERIDINE 95+% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(C)(C)OC(=O)N1CCC(CC1)(CC2CO2)O

Technology Process of 1-Boc-4-(oxiran-2-ylmethyl)-4-hydroxypiperidine

There total 3 articles about 1-Boc-4-(oxiran-2-ylmethyl)-4-hydroxypiperidine 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: 73.0%

1-(t-butoxycarbonyl)-4-(prop-2-enyl)-4-hydroxypiperidine (203662-51-5) → 4-hydroxy-4-(oxiran-2-ylmethyl)-piperidine-1-carboxylic acid tert-butyl ester (203662-52-6)

Guidance literature:

With dihydrogen peroxide; potassium carbonate; In methanol; water; acetonitrile; at 60 ℃; for 1h; Reagent/catalyst;

Reference yield:

sodium metabisulfite + 1-(t-butoxycarbonyl)-4-(prop-2-enyl)-4-hydroxypiperidine (203662-51-5) → 4-hydroxy-4-(oxiran-2-ylmethyl)-piperidine-1-carboxylic acid tert-butyl ester (203662-52-6)

Guidance literature:

With sodium hydrogencarbonate; 3-chloro-benzenecarboperoxoic acid; In dichloromethane; ethyl acetate;

Reference yield:

N-tert-butyloxycarbonylpiperidin-4-one (79099-07-3) → 4-hydroxy-4-(oxiran-2-ylmethyl)-piperidine-1-carboxylic acid tert-butyl ester (203662-52-6)

Guidance literature:

Multi-step reaction with 2 steps

1: zinc

2: 3-chloro-benzenecarboperoxoic acid

With 3-chloro-benzenecarboperoxoic acid; zinc;

DOI:10.1021/jacs.5b07384

upstream raw materials:

1-(t-butoxycarbonyl)-4-(prop-2-enyl)-4-hydroxypiperidine

N-tert-butyloxycarbonylpiperidin-4-one

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