(S)-1-N-Boc-piperidine-2-ethanol

Base Information

• Chemical Name: (S)-1-N-Boc-piperidine-2-ethanol
• CAS No.: 199942-74-0
• Molecular Formula: C12H23NO3
• Molecular Weight: 229.32
• European Community (EC) Number: 675-894-4
• DSSTox Substance ID: DTXSID30363812
• Nikkaji Number: J1.177.523C
• Wikidata: Q72484234
• Mol file: 199942-74-0.mol

Synonyms:(S)-1-N-Boc-piperidine-2-ethanol;199942-74-0;tert-butyl (2S)-2-(2-hydroxyethyl)piperidine-1-carboxylate;(S)-1-Boc-Piperidine-2-Ethanol;(s)-2-(2-hydroxy-ethyl)-piperidine-1-carboxylic acid tert-butyl ester;(S)-tert-butyl 2-(2-hydroxyethyl)piperidine-1-carboxylate;SCHEMBL2345014;(S)-N-Boc-piperidine-2-ethanol;AMY4261;DTXSID30363812;MFCD02683200;(s)-(-)-n-boc-piperidine-2-ethanol;AKOS015897904;1-Piperidinecarboxylic acid, 2-(2-hydroxyethyl)-, 1,1-dimethylethyl ester, (2S)-;AS-37030;CS-0154711;EN300-4346641;Q-102994;(2S)-1-(tert-Butoxycarbonyl)piperidine-2alpha-ethanol;1,1-dimethylethyl (2S)-2-(2-hydroxyethyl)-1-piperidinecarboxylate;(2S)-2-(2-hydroxy-ethyl)-piperidine-1-carboxylic acid tert-butyl ester;(S)-2-(2-hydroxyethyl)-piperidine-1-carboxylic acid tert-butyl ester;1-piperidinecarboxylic acid, 2-(2-hydroxyethyl)-, 1,1-dimethylethyl ester, (2s)

Chemical Property of (S)-1-N-Boc-piperidine-2-ethanol

Chemical Property:

• Vapor Pressure: 1.97E-05mmHg at 25°C
• Refractive Index: 1.478
• Boiling Point: 324.1 °C at 760 mmHg
• PKA: 15.15±0.10(Predicted)
• Flash Point: 149.8 °C
• PSA: 49.77000
• Density: 1.043 g/cm³
• LogP: 2.09630
• Storage Temp.: Sealed in dry,Room Temperature
• XLogP3: 1.7
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 4
• Exact Mass: 229.16779360
• Heavy Atom Count: 16
• Complexity: 235

Purity/Quality:

97% ^*data from raw suppliers

(S)-1-N-Boc-piperidine-2-ethanol ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: CC(C)(C)OC(=O)N1CCCCC1CCO
• Isomeric SMILES: CC(C)(C)OC(=O)N1CCCC[C@H]1CCO

Technology Process of (S)-1-N-Boc-piperidine-2-ethanol

There total 33 articles about (S)-1-N-Boc-piperidine-2-ethanol 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: 98.0%

(S)-2-(2-acetoxy-ethyl)-piperidine-1-carboxylic acid tert-butyl ester (639458-49-4) → (S)-2-(2-hydroxy-ethyl)-piperidine-1-carboxylic acid tert-butyl ester (199942-74-0)

Guidance literature:

With sodium carbonate; In methanol; at 20 ℃; for 4h;

DOI:10.1021/jo035215g

Reference yield: 95.0%

di-tert-butyl dicarbonate (24424-99-5) + benzyl (2S)-2-(2-hydroxyethyl)piperidine-1-carboxylate (190967-63-6) → (S)-2-(2-hydroxy-ethyl)-piperidine-1-carboxylic acid tert-butyl ester (199942-74-0)

Guidance literature:

benzyl (2S)-2-(2-hydroxyethyl)piperidine-1-carboxylate; With palladium 10% on activated carbon; hydrogen; In methanol; at 25 ℃; for 5h; under 1034.32 Torr;

di-tert-butyl dicarbonate; With iodine; for 3h;

DOI:10.1002/ejoc.201000169

Reference yield: 93.0%

(S)-2-{1-[(tert-butoxy)carbonyl]piperidin-2-yl}acetic acid (159898-10-9) → (S)-2-(2-hydroxy-ethyl)-piperidine-1-carboxylic acid tert-butyl ester (199942-74-0)

Guidance literature:

With lithium aluminium tetrahydride; In tetrahydrofuran; dichloromethane; at 55 ℃; for 4h; Inert atmosphere;

upstream raw materials:

(S)-2-(methoxycarbonylmethyl)piperidine-1-carboxylic acid tert-butyl ester

diazomethane

(S)-(-)-1-(tert-butoxycarbonyl)-2-piperidinecarboxylic acid

vinyl acetate

Downstream raw materials:

tert-butyl (S)-2-[2-(2-nitrophenylselenyl)ethyl]piperidine-1-carboxylate

(S)-2-[(4-benzylphenoxy)ethyl]-piperidine-1-carboxylic acid tert-butyl ester

(S,S)-2-(2-hydroxy-2-phenyl-ethyl)-piperidine-1-carboxylic acid tert-butyl ester

2-(2-hydroxy-2-phenyl-ethyl)-piperidine-1-carboxylic acid tert-butyl ester