1-Piperidinepropanoic acid, ethyl ester

Base Information

• Chemical Name: 1-Piperidinepropanoic acid, ethyl ester
• CAS No.: 19653-33-9
• Molecular Formula: C10H19NO2
• Molecular Weight: 185.266
• Hs Code.: 2933399090
• European Community (EC) Number: 243-205-2
• NSC Number: 75594
• UNII: Y5948MTH7R
• DSSTox Substance ID: DTXSID7066512
• Nikkaji Number: J28.235I
• Wikidata: Q81993092
• Mol file: 19653-33-9.mol

Synonyms:19653-33-9;ethyl 3-(piperidin-1-yl)propanoate;Ethyl 1-piperidinepropionate;1-Piperidinepropanoic acid, ethyl ester;ethyl 3-piperidin-1-ylpropanoate;1-Piperidinepropionic Acid Ethyl Ester;1-Piperidinepropionic acid, ethyl ester;Ethyl piperidine-1-propionate;Ethyl 1-piperidinepropanoate;Y5948MTH7R;Ethyl 3-piperidin-1-ylpropionate;EINECS 243-205-2;NSC 75594;NSC-75594;Ethyl 3-(1-piperidinyl)propionate;Ethyl Piperidinopropionate;Ethyl 3-piperidinopropionate;Ethyl-1-piperidinepropionate;NCIOpen2_000590;UNII-Y5948MTH7R;Ethyl 3-(Piperidino)propionate;SCHEMBL4619736;DTXSID7066512;1-piperidinepropionicacidethylester;ethyl3-(piperidin-1-yl)propanoate;HMS1703J11;Ethyl 3-(1-piperidinyl)propanoate;(2'-ethoxyc arbonylethyl)piperidine;NSC75594;1-Piperidinepropanoicacid,ethyl ester;BBL027594;MFCD00006514;STL353641;Ethyl 3-(1-piperidinyl)propanoate #;1-Piperidinepropanoic acid ethyl ester;AKOS004117975;1-Piperidine-propionic acid-ethyl ester;3-(Piperidino)propionic Acid Ethyl Ester;VS-08565;FT-0608272;P1305;EN300-16257;.beta.-(N-Piperidino)-propionic acid ethyl ester;Z53115951;F1791-1570

Chemical Property of 1-Piperidinepropanoic acid, ethyl ester

Chemical Property:

• Vapor Pressure: 0.129mmHg at 25°C
• Melting Point: 19ºC
• Refractive Index: 1.461
• Boiling Point: 218 °C at 760 mmHg
• PKA: 8.80±0.10(Predicted)
• Flash Point: 87.8 °C
• PSA: 29.54000
• Density: 0.984 g/cm³
• LogP: 1.36340
• XLogP3: 1.3
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 5
• Exact Mass: 185.141578849
• Heavy Atom Count: 13
• Complexity: 153

Purity/Quality:

99.9% ^*data from raw suppliers

Ethyl 1-Piperidinepropionate ^*data from reagent suppliers

Safty Information:

• Pictogram(s): Xi
• Hazard Codes: Xi
• Statements: 36/37/38
• Safety Statements: 26-36/37/39

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCOC(=O)CCN1CCCCC1
• Uses: Ethyl 3-piperidinepropionate is used in oxygenation reactions with gold nano particles.

Technology Process of 1-Piperidinepropanoic acid, ethyl ester

There total 14 articles about 1-Piperidinepropanoic acid, ethyl ester 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%

piperidine (110-89-4) + ethyl acrylate (140-88-5,9003-32-1) → ethyl piperidine-1-propionate (19653-33-9)

Guidance literature:

cobalt(II) acetate; In water; at 20 ℃; for 15h;

DOI:10.1002/hlca.200490139

Reference yield: 75.0%

N-(methoxymethyl)piperidine (18811-61-5) + 1-ethoxy-1-(trimethylsiloxy)ethene (18295-66-4) → ethyl piperidine-1-propionate (19653-33-9)

Guidance literature:

With hafnium(IV) trifluoromethanesulfonate; In dichloromethane; at 20 ℃; for 1h;

DOI:10.1055/s-0029-1216743

Reference yield: 53.0%

1-(2-Ethoxycarbonyl-1-methylsulfanyl-ethylidene)-piperidinium; iodide (114393-66-7) → ethyl piperidine-1-propionate (19653-33-9)

Guidance literature:

With sodium cyanoborohydride; 1.) ethanol; 2.) ethanolic HCl, overnight;

DOI:10.1021/jo00331a032

upstream raw materials:

piperidine

Ethyl 3-bromopropionate

diethyl meso-2,5-dibromoadipate

ethyl 3-iodopropanoate

Downstream raw materials:

ethyl acrylate

1-(4-methoxyphenyl)-3-(piperidin-1-yl)propan-1-one

3-(2-oxopiperidin-1-yl)propionic acid

3-(piperidin-1-yl)propanehydrazide

Refernces

• 1、 Schwolow, Sebastian,Heikenw?lder, Birgit,Abahmane, Lahbib,Kockmann, Norbert,R?der, Thorsten. "Kinetic and scale-up investigations of a michael addition in microreactors". . p. 1535 - 1544. Retrieved 2014.
• 2、 Xu, Li-Wen,Li, Lyi,Xia, Chun-Gu. "Transition-metal-based Lewis acid catalysis of aza-type Michael additions of amines to α,β-unsaturated electrophiles in water". . p. 1522 - 1526. Retrieved 2004.
• 3、 Sakai, Norio,Sato, Asuka,Konakahara, Takeo. "Practical synthesis of natural amino acid derivatives: Hf(OTf) 4-catalyzed Mannich-type reaction of ketene silyl acetals or enol silyl ethers with N,O-acetals as a glycine cation equivalent". . p. 1449 - 1452. Retrieved 2009.
• 4、 Muthusamy, Sengodagounder,Gunanathan, Chidambaram,Babu, Srinivasarao Arulananda. "Rhodium(II) acetate catalyzed synthesis of cyclic enamides and enamines via β-hydride elimination". . p. 471 - 474. Retrieved 2002.
• 5、 Weisel et al.. "-". . p. 1071,1972. Retrieved 1945.
• 6、 Junquera, Lourdes Benítez,Fernández, Francys E.,Puerta, M. Carmen,Valerga, Pedro. "Nickel(II) N-Heterocyclic Carbene Complexes: Versatile Catalysts for C–C, C–S and C–N Coupling Reactions". supporting information. p. 2547 - 2556. Retrieved 2017/05/29.