Methyl N-cbz-piperidine-2-carboxylate

Base Information

• Chemical Name: Methyl N-cbz-piperidine-2-carboxylate
• CAS No.: 180609-56-7
• Molecular Formula: C15H19 N O4
• Molecular Weight: 277.32
• Hs Code.: 2933399090
• European Community (EC) Number: 846-942-3
• DSSTox Substance ID: DTXSID60451852
• Nikkaji Number: J2.549.089D
• Mol file: 180609-56-7.mol

Synonyms:METHYL N-CBZ-PIPERIDINE-2-CARBOXYLATE;180609-56-7;1-O-benzyl 2-O-methyl piperidine-1,2-dicarboxylate;Piperidine-1,2-dicarboxylic acid 1-benzyl ester 2-methyl ester;Methyl 1-Cbz-piperidine-2-carboxylate;1,2-Piperidinedicarboxylic acid, 2-methyl 1-(phenylmethyl) ester;BENZYL 2-METHYLPIPERIDINE-1,2-DICARBOXYLATE;MFCD11111587;60369-19-9;R-METHYL1-CBZ-PIPERIDINE-2-CARBOXYLATE;S-METHYL1-CBZ-PIPERIDINE-2-CARBOXYLATE;Piperidine-1,2-dicarboxylic acid 1-benzyl 2-methyl ester;1-benzyl 2-methyl piperidine-1,2-dicarboxylate;SCHEMBL630096;DTXSID60451852;MethylN-Cbz-piperidine-2-carboxylate;AKOS015902133;SB43166;AM100404;DS-15547;SY023680;CS-0041207;FT-0771331;FT-0771417;A881102

Chemical Property of Methyl N-cbz-piperidine-2-carboxylate

Chemical Property:

• Boiling Point: 390.4±42.0 °C(Predicted)
• PKA: -3.33±0.40(Predicted)
• PSA: 66.84000
• Density: 1.187
• LogP: 2.59030
• Storage Temp.: Sealed in dry,Room Temperature
• XLogP3: 2.4
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 5
• Exact Mass: 277.13140809
• Heavy Atom Count: 20
• Complexity: 339

Purity/Quality:

97% ^*data from raw suppliers

MethylN-Cbz-piperidine-2-carboxylate ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: COC(=O)C1CCCCN1C(=O)OCC2=CC=CC=C2

Technology Process of Methyl N-cbz-piperidine-2-carboxylate

There total 6 articles about Methyl N-cbz-piperidine-2-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: 93.0%

N-benzyloxycarbonyl D/L-pipecolinic acid (28697-07-6) + methyl iodide (74-88-4) → 1-benzoxycarbonyl-2-methoxycarbonylpiperidine (180609-56-7)

Guidance literature:

With potassium hydrogencarbonate; In N,N-dimethyl-formamide; at 20 ℃; for 18h;

Reference yield: 61.0%

methanol (67-56-1) + N-benzyloxycarbonyl D/L-pipecolinic acid (28697-07-6) → 1-benzoxycarbonyl-2-methoxycarbonylpiperidine (180609-56-7)

Guidance literature:

N-benzyloxycarbonyl D/L-pipecolinic acid; With benzotriazol-1-ol; 1-ethyl-(3-(3-dimethylamino)propyl)-carbodiimide hydrochloride; In dichloromethane; at 20 ℃; for 1.5h;

methanol; In dichloromethane;

Reference yield:

benzyl chloroformate (501-53-1,94274-21-2) + methyl pipecolinate (35677-83-9,41994-45-0,43041-11-8,90710-04-6) → 1-benzoxycarbonyl-2-methoxycarbonylpiperidine (180609-56-7)

Guidance literature:

With triethylamine; In tetrahydrofuran; for 1h; Ambient temperature;

DOI:10.1007/BF00532038 DOI:10.1007/BF00532039

upstream raw materials:

benzyl chloroformate

methyl pipecolinate

N-benzyloxycarbonyl D/L-pipecolinic acid

methyl iodide

Downstream raw materials:

1-benzyloxycarbonyl-2-hydroxymethylpiperidine

2-(1-methyl-5-amino-1H-pyrazol-3-yl)piperidine-1-benzyl formate

2-(1-methyl-4-cyclohexenyl-5-amino-1H-pyrazol-3-yl)piperidine-1-benzyl formate

2-(3-methyl-5-oxy-4,5,6,7,8,9-hexahydro-3H-pyrazolo[3,4-c]isoquinolin-1-yl)piperdin-1-benzyl formate