4-Ethoxypiperidine

Base Information

• Chemical Name: 4-Ethoxypiperidine
• CAS No.: 1122-86-7
• Molecular Formula: C7H15NO
• Molecular Weight: 129.202
• Hs Code.: 2933399090
• European Community (EC) Number: 674-773-3
• DSSTox Substance ID: DTXSID10467701
• Wikidata: Q72472000
• Mol file: 1122-86-7.mol

Synonyms:4-ethoxypiperidine;1122-86-7;4-Ethoxy-piperidine;4-ethoxy piperidine;MFCD06247385;Piperidine, 4-ethoxy-;4-ethoxyl piperidine;SCHEMBL78025;DTXSID10467701;OYHQAXYDSYSGEI-UHFFFAOYSA-N;BCP11332;AKOS000172887;FS-5206;SB30710;NCGC00341294-01;BB 0253268;CS-0206667;FT-0601767;EN300-52306;F81702;AB01186826-03;A802540;Z274503162

Chemical Property of 4-Ethoxypiperidine

Chemical Property:

• Boiling Point: 172.866 °C at 760 mmHg
• PKA: 9.87±0.10(Predicted)
• Flash Point: 62.202 °C
• PSA: 21.26000
• Density: 0.92g/cm³
• LogP: 1.10370
• Storage Temp.: 2-8°C
• XLogP3: 0.6
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 2
• Exact Mass: 129.115364102
• Heavy Atom Count: 9
• Complexity: 69.3

Purity/Quality:

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

4-Ethoxypiperidine ^*data from reagent suppliers

Safty Information:

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

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCOC1CCNCC1

Technology Process of 4-Ethoxypiperidine

There total 2 articles about 4-Ethoxypiperidine 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%

tert-butyl 4-ethoxypiperidine-1-carboxylate (460367-82-2) → 4-ethoxypiperidine (1122-86-7)

Guidance literature:

tert-butyl 4-ethoxypiperidine-1-carboxylate; With trifluoroacetic acid; In dichloromethane; for 2h;

With potassium carbonate; In dichloromethane; water;

Reference yield:

→ 4-ethoxypiperidine (1122-86-7)

Guidance literature:

aus 4-Aethoxy-pyridin, H2 in wss.Me.;

DOI:10.1007/BF00905909

Reference yield: 100.0%

4-ethoxypiperidine (1122-86-7) + 1-fluoro-2-nitro-4-trifluoromethyl-benzene (367-86-2) → 4-ethoxy-1-(2-nitro-4-(trifluoromethyl)phenyl)piperidine

Guidance literature:

With triethylamine; In dichloromethane; at 20 ℃; for 16h;

upstream raw materials:

tert-butyl 4-ethoxypiperidine-1-carboxylate

Downstream raw materials:

4-(3-(4-ethoxypiperidine-1-carbonyl)benzyl)phthalazin-1(2H)-one

4-(3-(4-ethoxypiperidine-1-carbonyl)-4-fluorobenzyl)phthalazin-1(2H)-one

4-(3-(4-ethoxypiperidine-1-carbonyl)benzyl)-5,7-dimethyl-2,6-dihydro-1H-pyrrolo[3,4-d]pyridazin-1-one

5-chloro-4-(3-(4-ethoxypiperidine-1-carbonyl)-4-fluorobenzyl)phthalazin-1(2H)-one

Refernces

• 1、 -. "CHROMAN COMPOUNDS AS 5 -HTlB ANTAGONISTS". Page/Page column 79-80. . Retrieved 2010/11/27.