Benzyl Piperidine-4-carboxylate

Base Information

• Chemical Name: Benzyl Piperidine-4-carboxylate
• CAS No.: 103824-89-1
• Molecular Formula: C13H17NO2
• Molecular Weight: 219.283
• DSSTox Substance ID: DTXSID80465092
• Nikkaji Number: J1.973.154E
• Wikidata: Q82290781
• Mol file: 103824-89-1.mol

Synonyms:Benzyl Piperidine-4-carboxylate;103824-89-1;Benzyl 4-piperidinecarboxylate;4-Piperidinecarboxylic acid, phenylmethyl ester;Piperidine-4-carboxylic acid benzyl ester;SCHEMBL606466;DTXSID80465092;Benzyl piperidin-4-yl-carboxylate;BLBHAAHASZMYPI-UHFFFAOYSA-N;GEO-04512;AKOS010531375;CS-0120169

Chemical Property of Benzyl Piperidine-4-carboxylate

Chemical Property:

• XLogP3: 1.6
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 4
• Exact Mass: 219.125928785
• Heavy Atom Count: 16
• Complexity: 218

Purity/Quality:

98%min ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1CNCCC1C(=O)OCC2=CC=CC=C2

Technology Process of Benzyl Piperidine-4-carboxylate

There total 8 articles about Benzyl Piperidine-4-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: 100.0%

4-Benzyloxycarbonyl-1-tert-butoxycarbonylpiperidine (177990-33-9) → (+)-piperidine-4-carboxylic acid benzyl ester (103824-89-1)

Guidance literature:

With hydrogenchloride; In 1,4-dioxane; at 20 ℃;

Reference yield: 78.0%

isonipecotic acid (498-94-2) + benzyl alcohol (100-51-6,185532-71-2) → (+)-piperidine-4-carboxylic acid benzyl ester (103824-89-1)

Guidance literature:

With toluene-4-sulfonic acid; In benzene;

Reference yield: 75.0%

1-(3-methyl-2-butenyl)-4-(benzyloxycarbonyl)piperidine (648910-23-0) → (+)-piperidine-4-carboxylic acid benzyl ester (103824-89-1)

Guidance literature:

1-(3-methyl-2-butenyl)-4-(benzyloxycarbonyl)piperidine; With iodine; In methanol; at 20 ℃; for 7h;

With zinc; In methanol; at 20 ℃; for 0.5h;

DOI:10.1016/j.tetlet.2003.10.058

upstream raw materials:

4-Benzyloxycarbonyl-1-tert-butoxycarbonylpiperidine

1-(3-methyl-2-butenyl)-4-(benzyloxycarbonyl)piperidine

isonipecotic acid

N-[(3-methyl-2-butenyl)oxycarbonyl] isonipecotic acid

Downstream raw materials:

(S)-benzyl 1-(2-tert-butoxycarbonylaminopropanoyl)piperidine-4-carboxylate

benzyl 1-(2-tert-butoxy-2-oxoethyl)piperidine-4-carboxylate

(S)-benzyl 6-{[(benzyloxy)carbonyl]amino}-2-[1-((S)-2-tertbutoxycarbonylaminopropanoyl)piperidine-4-carboxamido]hexanoate

(S)-benzyl 6-benzyloxycarbonylamino-2-[1-(2-tertbutoxy-2-oxoethyl)piperidine-4-carboxamido]hexanoate