3-Piperidinecarboxylic acid, 4-(4-fluorophenyl)-, ethyl ester

Base Information

Chemical Name:3-Piperidinecarboxylic acid, 4-(4-fluorophenyl)-, ethyl ester
CAS No.:216690-20-9
Molecular Formula:C14H18FNO2
Molecular Weight:251.301
Hs Code.:
DSSTox Substance ID:DTXSID501180135
Mol file:216690-20-9.mol

Synonyms:SCHEMBL7674955;DTXSID501180135;3-Piperidinecarboxylic acid, 4-(4-fluorophenyl)-, ethyl ester;216690-20-9

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Chemical Property of 3-Piperidinecarboxylic acid, 4-(4-fluorophenyl)-, ethyl ester

Chemical Property:

XLogP3:2
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:4
Exact Mass:251.13215698
Heavy Atom Count:18
Complexity:277

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:

Useful:

Canonical SMILES:CCOC(=O)C1CNCCC1C2=CC=C(C=C2)F

Technology Process of 3-Piperidinecarboxylic acid, 4-(4-fluorophenyl)-, ethyl ester

There total 5 articles about 3-Piperidinecarboxylic acid, 4-(4-fluorophenyl)-, 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: 81.0%

: 500056-31-5
4-(4-fluoro-phenyl)-3,4,5,6-tetrahydro-pyridine-3-carboxylic acid ethyl ester

: 216690-20-9
4-(4-fluoro-phenyl)-piperidine-3-carboxylic acid ethyl ester

Guidance literature:: With hydrogen; 10% palladium on active carbon; In ethanol; at 70 ℃; for 16h; under 18751.9 Torr;
DOI:10.1002/1099-0690(200209)2002:18<3126::AID-EJOC3126<3.0.CO;2-1

Reference yield:

: 18861-57-9,50737-52-5
ethyl (E)-2-cyano-3-(4-fluorophenyl)-2-propenoate

: 216690-20-9
4-(4-fluoro-phenyl)-piperidine-3-carboxylic acid ethyl ester

Guidance literature:: Multi-step reaction with 5 steps

1: 100 percent / CH₂Cl₂ / 20 °C / 11251100 Torr

2: 93 percent / p-toluenesulfonic acid / 1.5 h / Heating

3: 95 percent / H₂; Na₂CO₃ / Raney Ni / ethanol; methanol / 16 h / 80 °C / 18751.9 Torr

4: 92 percent / 10percent aq. HCl / 0.25 h

5: 81 percent / H₂ / 10 palladium on activated coal / ethanol / 16 h / 70 °C / 18751.9 Torr

With hydrogen; sodium carbonate; toluene-4-sulfonic acid; 10% palladium on active carbon; nickel; In methanol; ethanol; dichloromethane;
DOI:10.1002/1099-0690(200209)2002:18<3126::AID-EJOC3126<3.0.CO;2-1

Reference yield:

: (4R,6S)-2,6-Diethoxy-4-(4-fluoro-phenyl)-5,6-dihydro-4H-pyran-3-carbonitrile

: 216690-20-9
4-(4-fluoro-phenyl)-piperidine-3-carboxylic acid ethyl ester

Guidance literature:: Multi-step reaction with 4 steps

1: 93 percent / p-toluenesulfonic acid / 1.5 h / Heating

2: 95 percent / H₂; Na₂CO₃ / Raney Ni / ethanol; methanol / 16 h / 80 °C / 18751.9 Torr

3: 92 percent / 10percent aq. HCl / 0.25 h

4: 81 percent / H₂ / 10 palladium on activated coal / ethanol / 16 h / 70 °C / 18751.9 Torr

With hydrogen; sodium carbonate; toluene-4-sulfonic acid; 10% palladium on active carbon; nickel; In methanol; ethanol;
DOI:10.1002/1099-0690(200209)2002:18<3126::AID-EJOC3126<3.0.CO;2-1