Ethyl 2-(pyrrolidin-1-yl)acetate

Base Information

• Chemical Name: Ethyl 2-(pyrrolidin-1-yl)acetate
• CAS No.: 22041-19-6
• Molecular Formula: C8H15NO2
• Molecular Weight: 157.21
• Hs Code.: 29339980
• DSSTox Substance ID: DTXSID80176515
• Nikkaji Number: J150.071F
• Wikidata: Q83046838
• Mol file: 22041-19-6.mol

Synonyms:22041-19-6;ethyl 2-(pyrrolidin-1-yl)acetate;ETHYL PYRROLIDIN-1-YLACETATE;Ethyl 1-pyrrolidineacetate;ETHYL PYRROLIDINOACETATE;ethyl 2-pyrrolidin-1-ylacetate;1-Pyrrolidineacetic acid, ethyl ester;Ethyl N-pyrrolidinylacetate;Ethyl 1-pyrrolidinylacetate;Pyrrolidin-1-yl-acetic acid ethyl ester;BRN 0118556;ethyl-1-pyrrolidineacetate;SCHEMBL65358;Ethyl 1-pyrrolidinylacetate #;DTXSID80176515;Pyrrolizinoacetic acid ethyl ester;1-Pyrrolidineaceticacid,ethyl ester;BBL013408;MFCD00012085;STL182832;AKOS003973584;VS-03817;2-(1-pyrrolidinyl)acetic acid ethyl ester;LS-137129;A4739;CS-0207255;FT-0650823

Chemical Property of Ethyl 2-(pyrrolidin-1-yl)acetate

Chemical Property:

• Appearance/Colour: clear light yellow liquid
• Vapor Pressure: 0.275mmHg at 25°C
• Refractive Index: 1.446-1.448
• Boiling Point: 203.7 °C at 760 mmHg
• Flash Point: 80 °C
• PSA: 29.54000
• Density: 1.021 g/cm³
• LogP: 0.58320
• XLogP3: 1
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 4
• Exact Mass: 157.110278721
• Heavy Atom Count: 11
• Complexity: 130

Purity/Quality:

98%min ^*data from raw suppliers

EthylPyrrolidin-1-ylacetate ^*data from reagent suppliers

Safty Information:

• Safety Statements: 24/25

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCOC(=O)CN1CCCC1

Technology Process of Ethyl 2-(pyrrolidin-1-yl)acetate

There total 4 articles about Ethyl 2-(pyrrolidin-1-yl)acetate 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: 94.7%

pyrrolidine (123-75-1) + chloroacetic acid ethyl ester (105-39-5) → ethyl 2-(pyrrolidin-1-yl) acetate (22041-19-6)

Guidance literature:

With potassium carbonate; In N,N-dimethyl-formamide; at 20 ℃; for 12h;

Reference yield: 93.0%

pyrrolidine (123-75-1) + diazoacetic acid ethyl ester (623-73-4) → ethyl 2-(pyrrolidin-1-yl) acetate (22041-19-6)

Guidance literature:

With porous-polymer-supported ruthenium(II)-phenyloxazoline complex catalyst; In dichloromethane; at 20 ℃; for 0.25h; Inert atmosphere;

DOI:10.14233/ajchem.2017.20192

Reference yield: 80.0%

pyrrolidine (123-75-1) + ethyl bromoacetate (105-36-2) → ethyl 2-(pyrrolidin-1-yl) acetate (22041-19-6)

Guidance literature:

With potassium carbonate; In N,N-dimethyl-formamide; at 20 ℃; for 16h;

upstream raw materials:

pyrrolidine

ethyl bromoacetate

chloroacetic acid ethyl ester

diazoacetic acid ethyl ester

Downstream raw materials:

1-(ethoxycarbonylmethyl)-2-piperidone

(pyrrolidinyl-1)methyl-1 cyclohexanol

trans-1-methyl-3-(1-pyrrolidyl)-4-phenyl-2-azetidinone

cis-1-methyl-3-(1-pyrrolidyl)-4-phenyl-2-azetidinone

Refernces

• 1、 -. "Hetero-aromatic compound and its use in medicine". Paragraph 1099; 1108-1110. . Retrieved 2019/07/04.
• 2、 Abu-Elfotoh, Abdel-Moneim. "Polymer-supported ruthenium(II)/phenyloxazoline complex: Reusable and highly selective catalyst for N-H insertion reactions". . p. 349 - 352. Retrieved 2017/01/24.