Ethyl 1-piperidinecarboxylate

Base Information

• Chemical Name: Ethyl 1-piperidinecarboxylate
• CAS No.: 5325-94-0
• Molecular Formula: C8H15 N O2
• Molecular Weight: 157.213
• Hs Code.: 2933399090
• European Community (EC) Number: 625-971-3
• NSC Number: 100911,236
• DSSTox Substance ID: DTXSID90201362
• Nikkaji Number: J50.652D
• Wikidata: Q83074570
• Mol file: 5325-94-0.mol

Synonyms:ethyl piperidine-1-carboxylate;5325-94-0;Ethyl 1-piperidinecarboxylate;N-Carbethoxypiperidine;Pentamethylene urethane;1-PIPERIDINECARBOXYLIC ACID, ETHYL ESTER;NSC 236;NSC 100911;1-piperidinecarboxylicacid;ethyl piperidinecarboxylate;BRN 0118408;piperidine-1-carboxylic acid ethyl ester;WLN: T6NTJ AVO2;5-20-02-00480 (Beilstein Handbook Reference);N-ethoxycarbonylpiperidine;1-ethoxycarbonyl-piperidine;NCIOpen2_001719;SCHEMBL675456;NSC236;SCHEMBL10518897;SCHEMBL10520595;SCHEMBL10521042;DTXSID90201362;NSC-236;ethyl-1-PIPERIDINECARBOXYLATE;Ethyl 1-piperidinecarboxylate, 97%;MFCD00047470;NSC100911;piperidine carboxylic acid ethyl ester;piperidinecarboxylic acid, ethyl ester;AKOS003846724;CS-W017967;NSC-100911;SB41371;DS-16911;LS-114712;FT-0635619;A870783

Chemical Property of Ethyl 1-piperidinecarboxylate

Chemical Property:

• Vapor Pressure: 0.127mmHg at 25°C
• Refractive Index: n20/D 1.459(lit.)
• Boiling Point: 218.3°Cat760mmHg
• Flash Point: 85.9°C
• PSA: 29.54000
• Density: 1.036g/cm³
• LogP: 1.56670
• Storage Temp.: Sealed in dry,Room Temperature
• XLogP3: 1.3
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 2
• Exact Mass: 157.110278721
• Heavy Atom Count: 11
• Complexity: 130

Purity/Quality:

99%, ^*data from raw suppliers

Ethyl1-piperidinecarboxylate ^*data from reagent suppliers

Safty Information:

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

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCOC(=O)N1CCCCC1
• Uses: N-acylpiperidine derivative,(Ethyl 1-piperidinecarboxylate) can be used in structure correlation studies with respect to mosquito repellent activity. N-acylpiperidine derivative used in structure correlation studies with respect to mosquito repellent activity.

Technology Process of Ethyl 1-piperidinecarboxylate

There total 7 articles about Ethyl 1-piperidinecarboxylate 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: 89.0%

1-[(Z)-2-nonenyl]piperidine (97463-22-4) → N-Ethoxycarbonylpiperidine (5325-94-0) + (Z)-1-chloronon-2-ene (67242-75-5)

Guidance literature:

With chloroformic acid ethyl ester; In benzene;

Reference yield: 89.0%

chloroformic acid ethyl ester (541-41-3) + 1-[(Z)-2-nonenyl]piperidine (97463-22-4) → N-Ethoxycarbonylpiperidine (5325-94-0) + (Z)-1-chloronon-2-ene (67242-75-5)

Guidance literature:

In benzene; Product distribution; further solvent, further stereoisomer, further allylic tertiary amines, stereoisomeric purity of the double bond;

Reference yield: 50.0%

5,6,7,8-Tetrahydro-4-phenyl-8a-piperidino-4H,4aH-1-benzo-2-pyrancarbonsaeuremethylester (98450-79-4) → N-Ethoxycarbonylpiperidine (5325-94-0) + α-Keto-γ-phenyl-γ-(2'-oxocyclohexenyl)-methylbutyrate

Guidance literature:

With potassium hydroxide; chloroformic acid ethyl ester; In dichloromethane; for 4h; Heating;

DOI:10.1002/ardp.19863190805

upstream raw materials:

piperidine

Ethyl benzoyl carbonate

ethyl phenyl carbonate

3-allyloxycarbonyloxy-5-methoxyphenol

Downstream raw materials:

(piperidino carbamoyl)-1 propylphosphonate de diethyle

N,N-pentamethylene methyl-2 (chloro-4 phenyl)-3 propene-2 amide

N,N-pentamethylene methyl-2 (methoxy-4 phenyl)-3 propene-2 amide

cyclohexyl piperidine-1-carboxylate

Refernces

• 1、 Ishii, Shideru,Nakayama, Hidenobu,Yoshida, Yasuhiko,Yamashita, Tadataka. "Novel Synthesis of Carbamic Ester from Carbon Dioxide, Amine, and Ortho Ester". . p. 455 - 458. Retrieved 2007/10/02.
• 2、 Germon, C.,Alexakis, A.,Normant, J. F.. "Alkenyl-copper derivatives. 28 (1) : Stereospecific synthesis of tertiary allylic amines of E and Z configuration". . p. 377 - 389. Retrieved 2007/10/02.