Methyl N-Boc-4-hydroxypiperidine-3-carboxylate

Base Information

• Chemical Name: Methyl N-Boc-4-hydroxypiperidine-3-carboxylate
• CAS No.: 406212-51-9
• Molecular Formula: C12H21NO5
• Molecular Weight: 259.302
• DSSTox Substance ID: DTXSID00594893
• Mol file: 406212-51-9.mol

Synonyms:406212-51-9;Methyl N-Boc-4-hydroxypiperidine-3-carboxylate;1-Tert-butyl 3-methyl 4-hydroxypiperidine-1,3-dicarboxylate;1-O-tert-butyl 3-O-methyl 4-hydroxypiperidine-1,3-dicarboxylate;MFCD18651699;SCHEMBL173440;DTXSID00594893;OULNMKPQUKNAHO-UHFFFAOYSA-N;AMY20575;AKOS015897686;SB43426;DS-13188;SY012634;DB-070063;CS-0102801;F11981;A873272;1-Tert-butyl3-methyl4-hydroxypiperidine-1,3-dicarboxylate;1-tert-butyl 3-methyl 4-hydroxy-1,3-piperidine-dicarboxylate;1-tert-butyl 3-methyl 4-hydroxy-1,3-piperidinedicarboxylate

Chemical Property of Methyl N-Boc-4-hydroxypiperidine-3-carboxylate

Chemical Property:

• Boiling Point: 352.1±42.0 °C(Predicted)
• PKA: 14.12±0.40(Predicted)
• PSA: 76.07000
• Density: 1.182±0.06 g/cm3(Predicted)
• LogP: 0.71520
• Storage Temp.: 2-8°C
• XLogP3: 1
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 4
• Exact Mass: 259.14197277
• Heavy Atom Count: 18
• Complexity: 323

Purity/Quality:

97% ^*data from raw suppliers

Methyln-boc-4-hydroxypiperidine-3-carboxylate ^*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(C(C1)C(=O)OC)O

Technology Process of Methyl N-Boc-4-hydroxypiperidine-3-carboxylate

There total 2 articles about Methyl N-Boc-4-hydroxypiperidine-3-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: 90.0%

methyl 1-tert-butoxycarbonyl-4-oxo-3-piperidinecarboxylate (161491-24-3) → rac-1-tert-butyl 3-methyl 4-hydroxypiperidine-1,3-dicarboxylate (406212-51-9)

Guidance literature:

With sodium tetrahydroborate; In methanol; ethyl acetate;

Reference yield:

di-tert-butyl dicarbonate (24424-99-5) + methyl 4-hydroxypiperidine-3-carboxylate (959958-24-8) → rac-1-tert-butyl 3-methyl 4-hydroxypiperidine-1,3-dicarboxylate (406212-51-9)

Guidance literature:

With sodium hydrogencarbonate; In dichloromethane; water; for 15h;

Reference yield:

C30H26F2N4O6S2 + 5-(4-hydroxyphenyl)-2-(tetrahydro-2H-pyran-2-yl)-2H-1,2,3-triazole-4-carbaldehyde + 4-(1H-imidazol-4-yl)-N-(1-(methylsulfonyl)piperidin-4-yl)-5-(trifluoromethyl)pyrimidin-2-amine + rac-1-tert-butyl 3-methyl 4-hydroxypiperidine-1,3-dicarboxylate (406212-51-9) + 1,1-difluoro-2-iodoethane (598-39-0) + C22H21NO4S + benzyl (R)-3-methyl-4-(piperidine-4-carbonyl)piperazine-1-carboxylate → 5-(4-(2,2-difluoroethoxy)phenyl)-2-(tetrahydro-2H-pyran-2-yl)-2H-1,2,3-triazole-4-carbaldehyde + C25H22F4N4O4S + C24H23F2NO4S + 1-(tert-butyl) 3-methyl 3-(2,2-difluoroethyl)-4-hydroxypiperidine-1,3-dicarboxylate + 4-(1-(2,2-difluoroethyl)-1H-imidazol-4-yl)-N-(1-(methylsulfonyl)piperidin-4-yl)-5-(trifluoromethyl)pyrimidin-2-amine

Guidance literature:

With potassium carbonate; In N,N-dimethyl-formamide; at 80 ℃; for 16h;

upstream raw materials:

methyl 1-tert-butoxycarbonyl-4-oxo-3-piperidinecarboxylate

di-tert-butyl dicarbonate

methyl 4-hydroxypiperidine-3-carboxylate

Refernces

• 1、 -. "SUBSTITUTED PYRIDOPYRAZINES AS NOVEL SYK INHIBITORS". Page/Page column 45. . Retrieved 2013/02/27.