Ethyl 3-cyclopentyl-3-oxopropanoate

Base Information

• Chemical Name: Ethyl 3-cyclopentyl-3-oxopropanoate
• CAS No.: 24922-00-7
• Molecular Formula: C10H16O3
• Molecular Weight: 184.235
• Hs Code.: 2918300090
• European Community (EC) Number: 877-622-1
• DSSTox Substance ID: DTXSID70457204
• Nikkaji Number: J1.666.670J
• Wikidata: Q72474099
• Mol file: 24922-00-7.mol

Synonyms:ETHYL 3-CYCLOPENTYL-3-OXOPROPANOATE;24922-00-7;3-cyclopentyl-3-oxo-propionic acid ethyl ester;C10H16O3;MFCD06410650;ETHYL3-CYCLOPENTYL-3-OXOPROPANOATE;Cyclopentanepropanoic acid, beta-oxo-, ethyl ester;SCHEMBL1617817;DTXSID70457204;MUDKQMLLCRJCEY-UHFFFAOYSA-N;AMY20482;BCP28328;Ethyl 3-Cyclopentyl-3-oxo-propionate;AKOS010951629;AB24795;DS-12458;SY005175;CS-0122089;FT-0648506;beta-Oxocyclopentanepropionic acid ethyl ester;EN300-299043;A848120;3-Cyclopentyl-3-oxo-propionic acid ethyl ester;Ethyl 3-Cyclopentyl-3-oxopropanoate

Chemical Property of Ethyl 3-cyclopentyl-3-oxopropanoate

Chemical Property:

• Vapor Pressure: 0.0165mmHg at 25°C
• Refractive Index: 1.466
• Boiling Point: 255.3 °C at 760 mmHg
• PKA: 10.51±0.20(Predicted)
• Flash Point: 106.1 °C
• PSA: 43.37000
• Density: 1.065 g/cm³
• LogP: 1.69890
• Storage Temp.: Sealed in dry,Room Temperature
• XLogP3: 1.9
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 5
• Exact Mass: 184.109944368
• Heavy Atom Count: 13
• Complexity: 192

Purity/Quality:

98%,99%, ^*data from raw suppliers

Ethyl3-Cyclopentyl-3-oxopropanoate ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCOC(=O)CC(=O)C1CCCC1

Technology Process of Ethyl 3-cyclopentyl-3-oxopropanoate

There total 13 articles about Ethyl 3-cyclopentyl-3-oxopropanoate 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: 99.0%

6-bicyclo<3.1.0>hexan-6-ol (71911-64-3) → ethyl 3-cyclopentyl-3-oxopropionate (24922-00-7)

Guidance literature:

In neat (no solvent); at 110 ℃;

DOI:10.1021/jo01289a011

Reference yield: 91.0%

3-cyclopentyl-2-diazo-3-hydroxy-propionic acid ethyl ester (811467-21-7) → ethyl 3-cyclopentyl-3-oxopropionate (24922-00-7)

Guidance literature:

With copper(II) sulfate; at 20 ℃; for 3h;

DOI:10.1016/j.tetlet.2006.10.059

Reference yield: 89.0%

Cyclopentanecarboxylic acid chloride (4524-93-0) → ethyl 3-cyclopentyl-3-oxopropionate (24922-00-7)

Guidance literature:

hydrogen ethyl malonate; With [2,2]bipyridinyl; n-butyllithium; In hexanes; at -65 - -55 ℃;

Cyclopentanecarboxylic acid chloride; In hexanes; at 20 ℃;

upstream raw materials:

2-cyclopentanecarbonyl-3-oxo-butyric acid ethyl ester

1-cyclopentylethanone

Diethyl carbonate

6-bicyclo<3.1.0>hexan-6-ol

Downstream raw materials:

7-hydroxy-2,3-dihydrocyclopenta[c]chromen-4(1H)-one

7,9-dihydroxy-2,3-dihydrocyclopenta[c]chromen-4(1H)-one

ethyl 2-(3-chlorobenzyl)-3-cyclopentyl-3-oxopropanoate

2-amino-4-chloro-6-cyclopentylpyrimidine

Refernces

• 1、 Lee, Minhan,Jung, Hoimin,Kim, Dongwook,Park, Jung-Woo,Chang, Sukbok. "Modular Tuning of Electrophilic Reactivity of Iridium Nitrenoids for the Intermolecular Selective α-Amidation of β-Keto Esters". supporting information. p. 11999 - 12004. Retrieved 2020/08/06.
• 2、 -. "GLYCINE B ANTAGONISTS". Page/Page column 67-68. . Retrieved 2010/12/29.