Methyl N-boc-2-piperidineacetate

Base Information

• Chemical Name: Methyl N-boc-2-piperidineacetate
• CAS No.: 183859-36-1
• Molecular Formula: C13H23NO4
• Molecular Weight: 193.67100
• Hs Code.: 2933399090
• DSSTox Substance ID: DTXSID20468784
• Nikkaji Number: J2.317.293C
• Mol file: 183859-36-1.mol

Synonyms:183859-36-1;METHYL N-BOC-2-PIPERIDINEACETATE;tert-Butyl 2-(2-methoxy-2-oxoethyl)piperidine-1-carboxylate;MFCD02179005;PIPERIDIN-2-YL-ACETIC ACID METHYL ESTER, HYDROCHLORIDE;MethylN-Boc-2-piperidineacetate;813433-73-7;N-Boc-2-Piperidine Acetic Acid methyl Ester;SCHEMBL1046911;DTXSID20468784;VJNWVGAZYYQKTF-UHFFFAOYSA-N;AC2594;AKOS010237881;SB43803;SB47985;SB48321;pyridine, 2-chloro-3-fluoro-4-methyl-;CS-11152;SY006982;FT-0716212;FT-0771428;A880804;J-522618;2-Methoxycarbonylmethyl-piperidine-1-carboxylic acid tert butyl ester;2-(methoxycarbonylmethyl)piperidine-1-carboxylic acid tert-butyl ester

Chemical Property of Methyl N-boc-2-piperidineacetate

Chemical Property:

• Vapor Pressure: 0.167mmHg at 25°C
• Boiling Point: 213.1oC at 760 mmHg
• Flash Point: 82.7oC
• PSA: 38.33000
• Density: 0.982g/cm3
• LogP: 1.82240
• XLogP3: 1.8
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 5
• Exact Mass: 257.16270821
• Heavy Atom Count: 18
• Complexity: 309

Purity/Quality:

97% ^*data from raw suppliers

Methyl piperidin-2-yl acetate hydrochloride ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(C)(C)OC(=O)N1CCCCC1CC(=O)OC

Technology Process of Methyl N-boc-2-piperidineacetate

There total 11 articles about Methyl N-boc-2-piperidineacetate 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: 86.0%

diazomethane (186581-53-3,908094-01-9,334-88-3) + 2-(1-(tert-butoxycarbonyl)-2-piperidinyl)acetic acid (149518-50-3) → methyl (+/-)-N-(tert-butyloxycarbonyl)piperidin-2-ylacetate (183859-36-1)

Guidance literature:

In diethyl ether; at 0 - 20 ℃;

DOI:10.1021/ja002662u

Reference yield: 80.0%

methanol (67-56-1) + 2-(piperidin-2-yl)acetic acid (19832-04-3) + di-tert-butyl dicarbonate (24424-99-5) → methyl (+/-)-N-(tert-butyloxycarbonyl)piperidin-2-ylacetate (183859-36-1)

Guidance literature:

methanol; 2-(piperidin-2-yl)acetic acid; With hydrogenchloride; for 36h;

di-tert-butyl dicarbonate; With triethylamine; In dichloromethane; at 20 - 40 ℃; for 24h;

DOI:10.1016/j.tetasy.2004.09.022

Reference yield: 48.0%

di-tert-butyl dicarbonate (24424-99-5) + piperidin-2-yl-acetic acid methyl ester hydrochloride (24153-01-3) → methyl (+/-)-N-(tert-butyloxycarbonyl)piperidin-2-ylacetate (183859-36-1)

Guidance literature:

With dmap; triethylamine; In chloroform; for 24h;

DOI:10.1016/j.tetasy.2007.01.027

upstream raw materials:

diazomethane

2-(1-(tert-butoxycarbonyl)-2-piperidinyl)acetic acid

(+/-) methyl N-tert-butyloxycarbonyl 2-piperidinecarboxylate

1,1-dibromomethane

Downstream raw materials:

(S)-2-{1-[(tert-butoxy)carbonyl]piperidin-2-yl}acetic acid

(R)-2-methoxycarbonylmethylpiperidine-1-carboxylic acid tert-butyl ester

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

tert-butyl 2-(2-hydroxyethyl)piperidine-1-carboxylate